broad_id
string
depmap_id
string
ccle_name
string
screen_id
string
upper_limit
int64
lower_limit
float64
slope
float64
r2
float64
auc
float64
ec50
float64
ic50
float64
name
string
moa
string
target
string
disease.area
string
indication
string
smiles
string
phase
string
passed_str_profiling
bool
row_name
string
BRD-K38527262-300-01-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.192595
2.778834
0.700811
0.913857
3.337395
3.97587
atiprimod
JAK inhibitor, STAT inhibitor
JAK2, STAT3
null
null
CCCC1(CCC)CCC2(CCN(CCCN(CC)CC)C2)CC1
Phase 2
true
ACH-000990
BRD-K38852836-001-02-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.101171
-0.035847
-0.055549
1
717,961.374991
null
ganetespib
HSP inhibitor
HSP90AA1
null
null
CC(C)c1cc(-c2n[nH]c(=O)n2-c2ccc3n(C)ccc3c2)c(O)cc1O
Phase 3
true
ACH-000990
BRD-K42495768-001-01-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.773796
2.073733
0.394728
0.937338
0.681187
null
tasisulam
apoptosis stimulant
null
null
null
Clc1ccc(C(=O)NS(=O)(=O)c2ccc(Br)s2)c(Cl)c1
Phase 3
true
ACH-000990
BRD-K42805893-001-04-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.788838
0.318972
0.03725
0.859524
0.0061
null
osimertinib
EGFR inhibitor
EGFR
oncology
non-small cell lung cancer (NSCLC)
COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1nccc(n1)-c1cn(C)c2ccccc12
Launched
true
ACH-000990
BRD-K42828737-001-03-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.808009
0.646758
-0.210069
0.903061
0.074142
null
sunitinib
FLT3 inhibitor, KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, RET tyrosine kinase inhibitor, VEGFR inhibitor
CSF1R, FGFR1, FLT1, FLT3, FLT4, KDR, KIT, PDGFRA, PDGFRB, RET
oncology
gastrointestinal stromal tumors (GIST), renal cell carcinoma (RCC), neuroendocrine tumors of pancreatic origin (PNET)
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C, CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C, CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C, CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
Launched
true
ACH-000990
BRD-K42898655-001-01-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.124003
0.03658
-0.00331
1
0.011066
null
temsirolimus
mTOR inhibitor
MTOR
oncology
renal cell carcinoma (RCC)
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@@H]1OC(=O)C(C)(CO)CO
Launched
true
ACH-000990
BRD-K43389675-001-02-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
-0.013721
1.154311
0.911815
0.734005
0.821187
0.802145
daunorubicin
RNA synthesis inhibitor, topoisomerase inhibitor
TOP2A, TOP2B
hematologic malignancy
acute myeloid leukemia (AML), acute lymphoblastic leukemia (ALL)
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O, COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O, COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O, COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O
Launched
true
ACH-000990
BRD-K44227013-001-06-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.644925
0.10619
0.047833
0.830141
0.179667
null
ponatinib
Bcr-Abl kinase inhibitor, FLT3 inhibitor, PDGFR tyrosine kinase receptor inhibitor
ABL1, BCR, FGFR1, FGFR2, FGFR3, FGFR4, FLT3, KDR, KIT, LCK, LYN, PDGFRA, RET, SRC, TEK
hematologic malignancy
chronic myeloid leukemia (CML), acute lymphoblastic leukemia (ALL)
CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4cccnn34)cc2C(F)(F)F)CC1, CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4cccnn34)cc2C(F)(F)F)CC1
Launched
true
ACH-000990
BRD-K44408410-001-17-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.059354
0.392051
-0.049599
1
0.004893
null
2-methoxyestradiol
hypoxia inducible factor inhibitor
COMT, CYP19A1, CYP1A1, CYP1B1, HIF1A, TUBB
null
null
COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O, COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O, COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O
Phase 2
true
ACH-000990
BRD-K44827188-001-06-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.975312
-0.016736
-0.012418
0.987824
0.015286
null
vismodegib
hedgehog pathway inhibitor, smoothened receptor antagonist
SMO
oncology
basal cell carcinoma (BCC)
Clc1cc(ccc1C(=O)Nc1ccc(Cl)c(c1)-c1ccccn1)S(C)(=O)=O
Launched
true
ACH-000990
BRD-K46386702-001-02-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.131003
0.791278
-0.180059
1
0.301107
null
ARRY-334543
EGFR inhibitor
ERBB2
null
null
C[C@@H]1COC(Nc2ccc3ncnc(Nc4ccc(OCc5nccs5)c(Cl)c4)c3c2)=N1
Phase 2
true
ACH-000990
BRD-K49328571-001-15-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.514792
0.300433
0.18883
0.628383
0.000829
null
dasatinib
Bcr-Abl kinase inhibitor, ephrin inhibitor, KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, src inhibitor, tyrosine kinase inhibitor
ABL1, ABL2, BLK, EPHA2, FGR, FRK, FYN, HCK, KIT, LCK, LYN, PDGFRB, SRC, SRMS, STAT5B, YES1
hematologic malignancy
chronic myeloid leukemia (CML), acute lymphoblastic leukemia (ALL)
Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1, Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Launched
true
ACH-000990
BRD-K49350383-001-14-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.015035
-0.230144
-0.089796
1
0.30403
null
thioguanine
purine antagonist
IMPDH1, IMPDH2
hematologic malignancy
acute myeloid leukemia (AML)
Nc1nc2nc[nH]c2c(=S)[nH]1, Nc1nc2nc[nH]c2c(=S)[nH]1, Nc1nc2nc[nH]c2c(=S)[nH]1
Launched
true
ACH-000990
BRD-K50010139-001-01-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.741582
0.856137
0.17009
0.895865
0.207104
null
poziotinib
EGFR inhibitor
EGFR, ERBB2, ERBB4
null
null
COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3F)c2cc1OC1CCN(CC1)C(=O)C=C, COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3F)c2cc1OC1CCN(CC1)C(=O)C=C
Phase 2
true
ACH-000990
BRD-K50168500-001-07-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.195991
0.695875
0.774491
0.760604
0.675006
1.37984
canertinib
EGFR inhibitor
AKT1, EGFR, ERBB2, ERBB4
null
null
Fc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)cc1Cl
Phase 3
true
ACH-000990
BRD-K51313569-001-07-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.386082
0.514388
0.416943
0.855156
1.984232
null
palbociclib
CDK inhibitor
CDK4, CDK6
oncology
breast cancer
CC(=O)c1c(C)c2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n(C2CCCC2)c1=O, CC(=O)c1c(C)c2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n(C2CCCC2)c1=O
Launched
true
ACH-000990
BRD-K51791723-003-01-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.014935
0.924811
0.396134
0.75795
1.043925
1.078744
P276-00
CDK inhibitor
CDK1, CDK4, CDK9
null
null
CN1CC[C@H]([C@@H]1CO)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
Phase 2
true
ACH-000990
BRD-K51967704-001-03-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.284314
0.235085
0.050314
1
3.675427
null
BIIB021
HSP inhibitor
HSP90AA1
null
null
COc1c(C)cnc(Cn2cnc3c(Cl)nc(N)nc23)c1C, COc1c(C)cnc(Cn2cnc3c(Cl)nc(N)nc23)c1C
Phase 2
true
ACH-000990
BRD-K52313696-001-12-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.912335
0.150062
0.017703
0.954335
0.043641
null
tacedinaline
HDAC inhibitor
HDAC1
null
null
CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N, CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N
Phase 3
true
ACH-000990
BRD-K53414658-001-08-2
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.935379
7.443731
0.050762
0.967899
0.080598
null
tivozanib
VEGFR inhibitor
FLT1, FLT4, KDR, KIT, PDGFRA, PDGFRB
null
null
COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(C)on4)c(Cl)c3)c2cc1OC
Phase 3
true
ACH-000990
BRD-K54256913-001-08-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.506703
0.247705
0.245248
0.732151
0.035899
null
MK-1775
WEE1 kinase inhibitor
WEE1
null
null
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(-c2cccc(n2)C(C)(C)O)n(CC=C)c3=O)cc1
Phase 2
true
ACH-000990
BRD-K54997624-001-06-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.549897
3.665065
0.763989
1
1.510374
null
alpelisib
PI3K inhibitor
PIK3CA, PIK3CB, PIK3CD, PIK3CG
null
null
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F
Phase 3
true
ACH-000990
BRD-K55187425-236-05-2
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.828734
0.30219
-0.13719
0.93997
0.84614
null
rigosertib
cell cycle inhibitor, PLK inhibitor
PLK1
null
null
COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1, COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1, COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1
Phase 3
true
ACH-000990
BRD-K56343971-001-14-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.080028
-0.354998
-0.104355
1
0.118451
null
vemurafenib
RAF inhibitor
BRAF, RAF1
oncology
melanoma
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F, CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F, CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
Launched
true
ACH-000990
BRD-K56981171-001-02-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.566966
-0.154528
-0.402526
0.780655
0.093217
null
brigatinib
ALK tyrosine kinase receptor inhibitor, EGFR inhibitor
ALK, EGFR
oncology
non-small cell lung cancer (NSCLC)
COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(C)CC1, COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(C)CC1
Launched
true
ACH-000990
BRD-K57080016-001-15-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.704765
-0.060965
0.01999
0.818933
159.07004
null
selumetinib
MEK inhibitor
MAP2K1
null
null
Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO, Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
Phase 3
true
ACH-000990
BRD-K57169635-001-04-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
-0.152677
0.576913
0.548408
0.747053
2.119484
1.335459
dacomitinib
EGFR inhibitor
EGFR, ERBB2, ERBB4
null
null
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCCCC1
Phase 3
true
ACH-000990
BRD-K58435339-001-03-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.269642
1.547775
0.278306
1
0.05321
null
AT13387
HSP antagonist
HSP90AA1
null
null
CC(C)c1cc(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c(O)cc1O, CC(C)c1cc(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c(O)cc1O
Phase 2
true
ACH-000990
BRD-K58529924-001-01-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.992004
0.210726
-0.036192
0.996522
0.318583
null
ONC201
AKT inhibitor, MAP kinase inhibitor
TNFSF10
null
null
Cc1ccccc1CN1C2=NCCN2C2=C(CN(Cc3ccccc3)CC2)C1=O
Phase 2
true
ACH-000990
BRD-K58550667-001-08-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.619592
0.297827
0.191597
0.82422
0.008855
null
FK-866
niacinamide phosphoribosyltransferase inhibitor
NAMPT
null
null
O=C(NCCCCC1CCN(CC1)C(=O)c1ccccc1)\C=C\c1cccnc1
Phase 2
true
ACH-000990
BRD-K59317601-001-05-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.419566
1.304227
0.653861
0.697261
0.063301
0.256946
MLN0128
mTOR inhibitor
MTOR, PIK3CA, PIK3CD, PIK3CG
null
null
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Phase 2
true
ACH-000990
BRD-K59369769-001-22-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.038985
-0.095177
-0.044934
1
45.38393
null
tozasertib
Aurora kinase inhibitor, Bcr-Abl kinase inhibitor, FLT3 inhibitor, JAK inhibitor
AURKA, AURKB, AURKC, LCK
null
null
CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1, CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Phase 2
true
ACH-000990
BRD-K60866521-001-07-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.831745
-3.398834
0.10954
0.910066
0.109169
null
idelalisib
PI3K inhibitor
PIK3CA, PIK3CB, PIK3CD, PIK3CG
hematologic malignancy
chronic lymphocytic leukemia (CLL)
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1
Launched
true
ACH-000990
BRD-K60997853-001-02-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.238182
0.786957
0.72558
0.786015
0.763085
1.736233
PHA-848125
CDK inhibitor, growth factor receptor inhibitor
CDK2, CDK4, CDK7, NTRK1
null
null
CNC(=O)c1nn(C)c-2c1C(C)(C)Cc1cnc(Nc3ccc(cc3)N3CCN(C)CC3)nc-21
Phase 2
true
ACH-000990
BRD-K61192372-001-08-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.745586
-10.65058
0.373544
0.764869
4.792681
null
capecitabine
DNA synthesis inhibitor, thymidylate synthase inhibitor
TYMS
oncology
breast cancer, colorectal cancer
CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O
Launched
true
ACH-000990
BRD-K62008436-001-23-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.75584
3.22156
0.106061
0.904878
0.014249
null
paclitaxel
tubulin polymerization inhibitor
BCL2, MAP2, MAP4, MAPT, NR1I2, TLR4, TUBB, TUBB1
oncology
ovarian cancer, breast cancer, non-small cell lung cancer (NSCLC)
CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
Launched
true
ACH-000990
BRD-K62196610-001-01-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.839529
0.133176
-0.001722
0.919471
0.073786
null
AVN-944
inosine monophosphate dehydrogenase inhibitor
IMPDH1, IMPDH2
null
null
CC[C@H](CC#N)OC(=O)N[C@@H](C)c1cccc(NC(=O)Nc2ccc(-c3cnco3)c(OC)c2)c1
Phase 2
true
ACH-000990
BRD-K62200014-003-10-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.690634
-2.516451
0.539422
0.93914
0.004102
null
anagrelide
phosphodiesterase inhibitor
PDE3A
hematology, hematologic malignancy
thrombocythemia, myeloproliferative neoplasms
Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl, Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl, Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl
Launched
true
ACH-000990
BRD-K62391742-001-09-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.299934
0.052432
0.054582
1
0.05182
null
venetoclax
BCL inhibitor
BCL2
hematologic malignancy
chronic lymphocytic leukemia (CLL)
CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1, CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1, CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1
Launched
true
ACH-000990
BRD-K62627508-001-01-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.545501
-0.074091
-0.011258
0.822174
0.000188
null
idasanutlin
MDM inhibitor
MDM2, TP53
null
null
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O
Phase 3
true
ACH-000990
BRD-K63504947-001-14-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.089207
-0.175398
-0.024408
1
5.95378
null
semaxanib
VEGFR inhibitor
FGFR1, FLT1, KDR, KIT, PDGFRA, PDGFRB, RET
null
null
Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
Phase 3
true
ACH-000990
BRD-K63712959-001-01-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.37487
2.099715
0.214453
1
1.417349
null
temoporfin
radical formation stimulant
null
oncology
head and neck squamous cell carcinoma (HNSCC)
Oc1cccc(c1)-c1c2CCc(n2)c(-c2cccc(O)c2)c2ccc([nH]2)c(-c2cccc(O)c2)c2ccc(n2)c(-c2cccc(O)c2)c2ccc1[nH]2
Launched
true
ACH-000990
BRD-K64881305-001-03-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.175161
-0.224174
-0.086829
1
0.03143
null
ispinesib
kinesin inhibitor
KIF11
null
null
CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1, CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1, CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1
Phase 2
true
ACH-000990
BRD-K66175015-001-12-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
-0.922964
0.623268
0.473248
0.804634
12.918596
2.412335
afatinib
EGFR inhibitor
EGFR, ERBB2, ERBB4
oncology
non-small cell lung cancer (NSCLC)
CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1, CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1, CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1
Launched
true
ACH-000990
BRD-K67844266-003-01-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.981723
-0.077279
0.000759
0.98919
9.905443
null
pevonedistat
nedd activating enzyme inhibitor
NAE1, UBA3
null
null
NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1ccc2c(N[C@H]3CCc4ccccc34)ncnc12
Phase 2
true
ACH-000990
BRD-K69001009-001-02-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.734929
-2.412871
0.394227
0.895025
0.028473
null
golvatinib
VEGFR inhibitor
KDR, MET
null
null
CN1CCN(CC1)C1CCN(CC1)C(=O)Nc1cc(Oc2ccc(NC(=O)C3(CC3)C(=O)Nc3ccc(F)cc3)c(F)c2)ccn1
Phase 2
true
ACH-000990
BRD-K69694239-001-02-2
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.223732
4.36464
0.654428
0.802185
0.843304
0.966081
bardoxolone-methyl
nuclear factor erythroid derived, like (NRF2) activator
PPARG, STAT3
null
null
COC(=O)[C@]12CCC(C)(C)C[C@H]1[C@H]1C(=O)C=C3[C@@]4(C)C=C(C#N)C(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
Phase 3
true
ACH-000990
BRD-K69776681-001-03-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.204162
2.872024
0.225215
1
0.007855
null
volasertib
PLK inhibitor
PLK1
null
null
CC[C@H]1N(C(C)C)c2nc(Nc3ccc(cc3OC)C(=O)N[C@H]3CC[C@@H](CC3)N3CCN(CC4CC4)CC3)ncc2N(C)C1=O, CC[C@H]1N(C(C)C)c2nc(Nc3ccc(cc3OC)C(=O)N[C@H]3CC[C@@H](CC3)N3CCN(CC4CC4)CC3)ncc2N(C)C1=O
Phase 3
true
ACH-000990
BRD-K70301465-001-05-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.774102
0.134525
0.005224
0.909857
1.821782
null
ibrutinib
Bruton's tyrosine kinase (BTK) inhibitor
BLK, BMX, BTK
hematologic malignancy
chronic lymphocytic leukemia (CLL), mantle cell lymphoma (MCL), Waldenstrom's macroglobulinemia (WM)
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C, Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
Launched
true
ACH-000990
BRD-K70401845-001-15-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.817904
3.059058
0.10696
0.892663
0.032783
null
erlotinib
EGFR inhibitor
EGFR, NR1I2
oncology
non-small cell lung cancer (NSCLC), pancreatic cancer
COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC, COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
Launched
true
ACH-000990
BRD-K73838513-003-05-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.942051
-0.006172
-0.041464
0.966893
12,628,249,252,992,858,000
null
cinacalcet
calcium channel activator
CASR
endocrinology, nephrology, oncology
hyperparathyroidism, chronic kidney disease (CKD), parathyroid carcinoma, hypercalcemia
C[C@@H](NCCCc1cccc(c1)C(F)(F)F)c1cccc2ccccc12
Launched
true
ACH-000990
BRD-K74514084-003-09-2
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.461424
0.065784
-0.023721
0.871988
4,417,242.537577
null
pazopanib
KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
CSF1R, FGF1, FGFR1, FGFR3, FLT1, FLT4, ITK, KDR, KIT, PDGFRA, PDGFRB, SH2B3
oncology
renal cell carcinoma (RCC), soft tissue sarcoma (STS)
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1, CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
Launched
true
ACH-000990
BRD-K75009076-001-02-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
-0.019581
1.755579
0.625033
0.870041
3.109765
3.042452
SCH-900776
CHK inhibitor
CDK2, CHEK1
null
null
Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)[C@@H]1CCCNC1, Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)[C@@H]1CCCNC1
Phase 2
true
ACH-000990
BRD-K76210423-001-01-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.126187
4.05121
-0.073966
1
0.047139
null
resiquimod
toll-like receptor agonist
TLR7, TLR8
null
null
CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O, CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O
Phase 3
true
ACH-000990
BRD-K76239644-001-02-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.466005
5.663687
0.559878
0.818536
0.36962
0.594158
BMS-690514
EGFR inhibitor, VEGFR inhibitor
EGFR, ERBB2, FLT3, KDR
null
null
COc1cccc(Nc2ncnn3ccc(CN4CC[C@@H](N)[C@H](O)C4)c23)c1, COc1cccc(Nc2ncnn3ccc(CN4CC[C@@H](N)[C@H](O)C4)c23)c1
Phase 2
true
ACH-000990
BRD-K76674262-001-03-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.124514
12.389749
0.906403
0.732691
0.516597
0.528675
homoharringtonine
protein synthesis inhibitor
RPL3
hematologic malignancy
chronic myeloid leukemia (CML)
COC(=O)C[C@](O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN3CCC[C@]23C=C1OC
Launched
true
ACH-000990
BRD-K76908866-001-07-6
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.863998
-0.22199
0.004569
0.928886
0.122714
null
CP-724714
EGFR inhibitor, protein tyrosine kinase inhibitor
ERBB2
null
null
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
Phase 2
true
ACH-000990
BRD-K77625799-001-07-7
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.751733
0.233257
0.126306
0.896086
0.369866
null
vandetanib
EGFR inhibitor, RET tyrosine kinase inhibitor, VEGFR inhibitor
EGFR, EPHA1, EPHA10, EPHA2, EPHA3, EPHA4, EPHA5, EPHA6, EPHA7, EPHA8, EPHB1, EPHB2, EPHB3, EPHB4, EPHB6, ERBB2, ERBB3, ERBB4, FLT1, FLT4, KDR, PTK6, RET, SRC, TEK, VEGFA
oncology
medullary thyroid cancer (MTC)
COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
Launched
true
ACH-000990
BRD-K78431006-001-15-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.888182
-0.094597
-0.039651
0.929838
21.240283
null
crizotinib
ALK tyrosine kinase receptor inhibitor
ALK, MET
oncology
non-small cell lung cancer (NSCLC)
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl, C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl, C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Launched
true
ACH-000990
BRD-K79254416-001-21-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
-0.114746
0.558032
0.071896
0.944033
79.58398
null
decitabine
DNA methyltransferase inhibitor
DNMT1, DNMT3A
hematologic malignancy, hematology
myelodysplastic diseases (MDS), anemia, chronic myeloid leukemia (CML)
Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1, Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1, Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
Launched
true
ACH-000990
BRD-K81016934-001-02-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.792388
1.091487
0.135735
0.838721
0.004861
null
INC-280
c-Met inhibitor
MET
null
null
CNC(=O)c1ccc(cc1F)-c1cnc2ncc(Cc3ccc4ncccc4c3)n2n1
Phase 2
true
ACH-000990
BRD-K81418486-001-44-2
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.732879
2.278058
0.052125
0.920792
0.563013
null
vorinostat
HDAC inhibitor
HDAC1, HDAC10, HDAC11, HDAC2, HDAC3, HDAC5, HDAC6, HDAC8, HDAC9
hematologic malignancy
cutaneous T-cell lymphoma (CTCL)
ONC(=O)CCCCCCC(=O)Nc1ccccc1, ONC(=O)CCCCCCC(=O)Nc1ccccc1, ONC(=O)CCCCCCC(=O)Nc1ccccc1
Launched
true
ACH-000990
BRD-K81473043-001-19-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
2.284258
0.694239
0.362948
1
0.500803
null
tanespimycin
HSP inhibitor
HSP90AA1
null
null
CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O, CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
Phase 3
true
ACH-000990
BRD-K82135108-001-04-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.167208
0.075153
-0.002798
1
0.030959
null
elesclomol
oxidative stress inducer
HSPA1A
null
null
CN(NC(=O)CC(=O)NN(C)C(=S)c1ccccc1)C(=S)c1ccccc1
Phase 3
true
ACH-000990
BRD-K82746043-001-19-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.240437
1.92007
0.705122
0.557256
0.034931
0.049148
navitoclax
BCL inhibitor
BCL2, BCL2L1, BCL2L2
null
null
CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1, CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
Phase 2
true
ACH-000990
BRD-K82818427-001-04-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.60139
0.572634
0.414917
0.782849
0.047716
null
batimastat
matrix metalloprotease inhibitor
ADAM28, ADAMTS5, MMP12, MMP16, MMP2, MMP8
null
null
CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(=O)NO, CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(=O)NO
Phase 3
true
ACH-000990
BRD-K83029223-001-01-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.805283
7.25125
0.337895
0.902226
0.00478
null
litronesib
kinesin-like spindle protein inhibitor
KIF11
null
null
CCNCCS(=O)(=O)NC[C@]1(SC(NC(=O)C(C)(C)C)=NN1C(=O)C(C)(C)C)c1ccccc1
Phase 2
true
ACH-000990
BRD-K83988098-001-02-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.731022
-1.043848
-0.107726
0.942767
0.000067
null
alvespimycin
HSP inhibitor
HSP90AA1
null
null
CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O, CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
Phase 2
true
ACH-000990
BRD-K85402309-043-01-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.857753
-0.119944
-0.127214
0.926775
0.064585
null
dovitinib
EGFR inhibitor, FGFR inhibitor, FLT3 inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
CSF1R, EGFR, FGFR1, FGFR2, FGFR3, FLT1, FLT3, FLT4, INSR, KDR, KIT, PDGFRA, PDGFRB
null
null
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
Phase 3
true
ACH-000990
BRD-K86118762-001-01-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.009157
-0.362368
-0.186056
1
0.64997
null
linsitinib
IGF-1 inhibitor
IGF1R, INSR, INSRR
null
null
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12, C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12
Phase 3
true
ACH-000990
BRD-K86972824-001-01-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.894588
-0.3391
0.065307
0.948522
0.066081
null
oltipraz
nuclear factor erythroid derived, like (NRF2) activator
ANG
null
null
Cc1c(ssc1=S)-c1cnccn1, Cc1c(ssc1=S)-c1cnccn1
Phase 3
true
ACH-000990
BRD-K87737963-001-06-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.702321
-1.532545
0.228344
0.956103
0.002362
null
cyt387
null
JAK1, JAK2, JAK3
null
null
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1, O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
Phase 3
true
ACH-000990
BRD-K87782578-001-01-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.726248
0.958723
0.115901
0.884146
0.167155
null
AVL-292
Bruton's tyrosine kinase (BTK) inhibitor
BTK, YES1
null
null
COCCOc1ccc(Nc2ncc(F)c(Nc3cccc(NC(=O)C=C)c3)n2)cc1
Phase 2
true
ACH-000990
BRD-K87909389-003-03-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.226817
3.963534
0.736346
0.726124
0.321428
0.374384
alvocidib
CDK inhibitor
CDK1, CDK2, CDK4, CDK5, CDK6, CDK7, CDK8, CDK9, EGFR, PYGM
null
null
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl, CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
Phase 2
true
ACH-000990
BRD-K88510285-001-17-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.125289
7.067947
0.782495
0.611815
0.033741
0.035146
bortezomib
NFkB pathway inhibitor, proteasome inhibitor
PSMA1, PSMA2, PSMA3, PSMA4, PSMA5, PSMA6, PSMA7, PSMA8, PSMB1, PSMB10, PSMB11, PSMB2, PSMB3, PSMB4, PSMB5, PSMB6, PSMB7, PSMB8, PSMB9, PSMD1, PSMD2, RELA
hematologic malignancy
multiple myeloma, mantle cell lymphoma (MCL)
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
Launched
true
ACH-000990
BRD-K89014967-001-04-3
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.678855
-2.301994
0.223235
0.739861
1.592566
null
AS-703026
MEK inhibitor
MAP2K1, MAP2K2
null
null
OC[C@@H](O)CNC(=O)c1ccncc1Nc1ccc(I)cc1F
Phase 2
true
ACH-000990
BRD-K92441787-001-04-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.886028
-3.516909
0.095123
0.93446
0.161802
null
bexarotene
retinoid receptor agonist
RXRA, RXRB, RXRG
hematologic malignancy
cutaneous T-cell lymphoma (CTCL)
Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C
Launched
true
ACH-000990
BRD-K92723993-001-17-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.998797
-0.014552
-0.000176
0.999409
0.006544
null
imatinib
Bcr-Abl kinase inhibitor, KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor
ABL1, CSF1R, DDR1, KIT, NTRK1, PDGFRA, PDGFRB, RET
hematologic malignancy, oncology
chronic myeloid leukemia (CML), acute lymphoblastic leukemia (ALL), myelodysplastic diseases (MDS), aggressive systemic mastocytosis (ASM), hypereosinophilic syndrome (HES), chronic eosinophilic leukemia (CEL), dermatofibrosarcoma protuberans (DFSP), gastrointestinal stromal tumors (GIST)
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1, CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1, CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Launched
true
ACH-000990
BRD-K95142244-001-01-5
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.027884
-0.04108
-0.183062
1
2.493485
null
talazoparib
PARP inhibitor
PARP2
null
null
Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(F)cc1
Phase 3
true
ACH-000990
BRD-K96123349-236-02-8
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.155879
0.030643
-0.005754
1
0.00055
null
brequinar
dihydroorotate dehydrogenase inhibitor
DHODH
null
null
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
Phase 2
true
ACH-000990
BRD-K98572433-001-02-9
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.937742
0.513878
0.001958
0.963258
0.02762
null
AZD8931
EGFR inhibitor
EGFR, ERBB2, ERBB3
null
null
CNC(=O)CN1CCC(CC1)Oc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC
Phase 2
true
ACH-000990
BRD-K99113996-001-02-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.495464
0.592693
0.362079
0.781374
0.161533
null
AZD2014
mTOR inhibitor
MTOR
null
null
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C
Phase 2
true
ACH-000990
BRD-K99616396-001-05-1
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
0.916827
-2.625369
-0.063491
0.934337
1.298586
null
motesanib
KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
FLT1, FLT4, KDR, KIT
null
null
CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12
Phase 3
true
ACH-000990
BRD-K99749624-001-07-0
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.397977
1.441092
0.791615
1
0.146792
null
linifanib
PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
CSF1, CSF1R, FLT1, FLT3, FLT4, KDR, KIT, PDGFRB, RET, TEK
null
null
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
Phase 3
true
ACH-000990
BRD-M97302542-001-04-4
ACH-000990
HEC108_ENDOMETRIUM
MTS010
1
1.047133
0.067101
-0.069985
1
0.513349
null
dichloroacetate
pyruvate dehydrogenase kinase inhibitor
PDK1
null
null
[Na].OC(=O)C(Cl)Cl, [Na].OC(=O)C(Cl)Cl
Phase 3
true
ACH-000990
BRD-A25234499-001-19-1
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
1.036537
-0.114854
-0.096474
1
1.044944
null
aminoglutethimide
glucocorticoid receptor antagonist
CYP11A1, CYP19A1
endocrinology, oncology
Cushing's syndrome, breast cancer
CCC1(CCC(=O)NC1=O)c1ccc(N)cc1, CCC1(CCC(=O)NC1=O)c1ccc(N)cc1, CCC1(CCC(=O)NC1=O)c1ccc(N)cc1
Launched
true
ACH-000991
BRD-A70858459-001-01-7
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.729595
0.02189
-0.152579
0.920398
17,875,370,086,010,278
null
estramustine
DNA alkylating agent
ESR1, ESR2, MAP1A, MAP2
oncology
prostate cancer
C[C@]12CCC3C(CCc4cc(OC(=O)N(CCCl)CCCl)ccc34)C1CC[C@@H]2O
Launched
true
ACH-000991
BRD-K02113016-001-19-6
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.558478
0.083913
-0.011818
0.720624
0.000109
null
olaparib
PARP inhibitor
PARP1, PARP2
oncology
ovarian cancer
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1, Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1
Launched
true
ACH-000991
BRD-K02130563-001-11-4
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.229254
4.680042
0.482867
0.697456
0.221614
0.252652
panobinostat
HDAC inhibitor
HDAC1, HDAC2, HDAC3, HDAC4, HDAC6, HDAC7, HDAC8, HDAC9
hematologic malignancy
multiple myeloma
Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1
Launched
true
ACH-000991
BRD-K03390685-001-01-7
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.753907
0.428311
0.099297
0.913276
0.512964
null
cobimetinib
MEK inhibitor
null
oncology
melanoma
OC1(CN(C1)C(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F)[C@@H]1CCCCN1
Launched
true
ACH-000991
BRD-K03406345-001-21-1
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.835617
-0.060919
-0.090006
0.887338
30,294.523544
null
azacitidine
DNA methyltransferase inhibitor
DNMT1, DNMT3A
hematologic malignancy, hematology
myelodysplastic diseases (MDS), anemia, chronic myelomonocytic leukemia (CMMoL)
Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1, Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1, Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
Launched
true
ACH-000991
BRD-K03449891-001-08-6
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.73183
1.055023
-0.181824
0.807823
0.00905
null
foretinib
VEGFR inhibitor
FLT1, FLT4, KDR, MET
null
null
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
Phase 2
true
ACH-000991
BRD-K03765900-001-01-9
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
1.00306
-0.196754
-0.04606
1
0.220711
null
XL-647
EGFR inhibitor, VEGFR inhibitor
EGFR, EPHB4, ERBB2, FLT4, KDR
null
null
COc1cc2c(Nc3ccc(Cl)c(Cl)c3F)ncnc2cc1OC[C@H]1C[C@H]2CN(C)C[C@H]2C1
Phase 3
true
ACH-000991
BRD-K05804044-001-18-5
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
1.849071
1.056891
0.143304
1
4.82263
null
AZ-628
RAF inhibitor
BRAF, RAF1
null
null
Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1
Preclinical
true
ACH-000991
BRD-K06814349-304-02-7
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.512132
2.796531
0.369954
0.875099
0.833933
null
fosbretabulin
tubulin polymerization inhibitor, VE-cadherin antagonist
CDH5
null
null
COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)cc1OP(O)(O)=O, COc1ccc(cc1OP(O)(O)=O)\C=C/c1cc(OC)c(OC)c(OC)c1, COc1ccc(cc1OP(O)(O)=O)\C=C/c1cc(OC)c(OC)c(OC)c1, COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)cc1OP(O)(O)=O
Phase 3
true
ACH-000991
BRD-K08109215-001-06-4
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.807686
2.652683
-0.081243
0.881374
0.025132
null
I-BET-762
bromodomain inhibitor
BRD2, BRD3, BRD4
null
null
CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12
Phase 2
true
ACH-000991
BRD-K08542803-001-02-3
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.90164
-1.55031
-0.043506
0.960647
0.029575
null
gambogic-acid
caspase activator
BCL2
null
null
CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C, CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C, CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C
Phase 2
true
ACH-000991
BRD-K08547377-001-04-4
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.768604
0.143299
-0.099489
0.847118
0.000624
null
irinotecan
topoisomerase inhibitor
TOP1, TOP1MT
oncology
colorectal cancer
CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12
Launched
true
ACH-000991
BRD-K08703257-001-13-9
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
0.954939
-0.138575
0.00379
0.977439
0.079664
null
3-amino-benzamide
PARP inhibitor
PARP1
null
null
NC(=O)c1cccc(N)c1, NC(=O)c1cccc(N)c1
Phase 2
true
ACH-000991
BRD-K08799216-001-05-3
ACH-000991
SNU81_LARGE_INTESTINE
MTS010
1
1.442116
-0.292387
0.010204
1
0.072147
null
pelitinib
EGFR inhibitor
EGFR
null
null
CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Phase 2
true
ACH-000991