| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L057901
BDB057901
|
BDBM50498684
O=C(O)c1ccnc(-c2cn(C3CN(C(=O)CCc4ccccc4)C3)nn2)c1
|
C20H19N5O3 377.404000 |
GJHLWPKIIBGQEY-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498684; PubChem:CID122191472
|
Local ready
Direct docking supported
|
|
E3L057902
BDB057902
|
BDBM50498685
O=C(O)c1ccnc(-c2cn(C3CCN(C(=O)CCc4ccccc4)CC3)nn2)c1
|
C22H23N5O3 405.458000 |
GPIMYLGSSWKBOE-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498685; PubChem:CID122191466
|
Local ready
Direct docking supported
|
|
E3L057903
BDB057903
|
BDBM50498686
O=C(O)c1ccnc(-c2cn(C3CCN(C(=O)Cc4ccccc4)CC3)nn2)c1
|
C21H21N5O3 391.431000 |
CIUXWFJDEFQEFY-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498686; PubChem:CID122191465
|
Local ready
Direct docking supported
|
|
E3L057904
BDB057904
|
BDBM50498687
O=C(O)c1ccnc(-c2cn(C3CCN(C(=O)c4ccccc4)CC3)nn2)c1
|
C20H19N5O3 377.404000 |
ANQUCAXLTCZJAM-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498687; PubChem:CID122191464
|
Local ready
Direct docking supported
|
|
E3L057905
BDB057905
|
BDBM50498688
O=C(O)c1ccnc(-c2cn(CCOc3ccccc3)nn2)c1
|
C16H14N4O3 310.313000 |
VNWFVBKYDNHUKU-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498688; PubChem:CID122191460
|
Local ready
Direct docking supported
|
|
E3L057906
BDB057906
|
BDBM50498689
O=C(O)c1ccnc(-c2cn(CCc3ccccc3)nn2)c1
|
C16H14N4O2 294.314000 |
WJDRQPCTXDWIML-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498689; PubChem:CID122191459
|
Local ready
Direct docking supported
|
|
E3L057907
BDB057907
|
2-(1-Methyltriazol-4-yl)pyridine-4-carboxylic acid
Cn1cc(-c2cc(C(=O)O)ccn2)nn1
|
C9H8N4O2 204.189000 |
WHNUAGDJIRFVOY-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498690; PubChem:CID122191452
|
Local ready
Direct docking supported
|
|
E3L057908
BDB057908
|
2-(1-Ethyltriazol-4-yl)pyridine-4-carboxylic acid
CCn1cc(-c2cc(C(=O)O)ccn2)nn1
|
C10H10N4O2 218.216000 |
NSQHTOYNQBVVKP-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498691; PubChem:CID122191454
|
Local ready
Direct docking supported
|
|
E3L057909
BDB057909
|
BDBM50498692
CCCC(=O)N1CCC(n2cc(-c3cc(C(=O)O)ccn3)nn2)CC1
|
C17H21N5O3 343.387000 |
CHWAPSKXJBOBBW-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498692; PubChem:CID122191463
|
Local ready
Direct docking supported
|
|
E3L057910
BDB057910
|
BDBM50498693
O=C(O)c1ccnc(-c2cn(C3CN(C(=O)Cc4ccccc4)C3)nn2)c1
|
C19H17N5O3 363.377000 |
DMRXEVDQPBLDBC-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50498693; PubChem:CID122191471
|
Local ready
Direct docking supported
|
|
E3L057911
BDB057911
|
BDBM50498882
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@H](c3cccc(C(C)C)c3)C3CC3)cc12
|
C38H38N2O3 570.733000 |
QWBMMUAFOHSGAA-BHVANESWSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498882; PubChem:CID54579783
|
Local ready
Direct docking supported
|
|
E3L057912
BDB057912
|
BDBM50498883
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)C)c3)cc12
|
C36H36N2O3 544.695000 |
LETNSIWDILDIKU-DEOSSOPVSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498883; PubChem:CID53362000
|
Local ready
Direct docking supported
|
|
E3L057913
BDB057913
|
BDBM50498884
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(Cl)c3)cc12
|
C33H29ClN2O3 537.059000 |
SPZPQRKTGHMKOS-NRFANRHFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498884; PubChem:CID53389233
|
Local ready
Direct docking supported
|
|
E3L057914
BDB057914
|
BDBM50498885
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3ccc(C(C)C)cc3)cc12
|
C36H36N2O3 544.695000 |
ZVFXZTVFMARNCX-DEOSSOPVSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498885; PubChem:CID53362018
|
Local ready
Direct docking supported
|
|
E3L057915
BDB057915
|
BDBM50498886
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(C(C)(C)O)c3)cc12
|
C36H36N2O4 560.694000 |
YBGREAIYNRSEAK-QHCPKHFHSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498886; PubChem:CID127035275
|
Local ready
Direct docking supported
|
|
E3L057916
BDB057916
|
BDBM50498887
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](c3cccc(C(C)C)c3)C(F)(F)F)cc12
|
C36H33F3N2O3 598.665000 |
HUWYEWSRWXKTAX-XIFFEERXSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498887; PubChem:CID127035427
|
Local ready
Direct docking supported
|
|
E3L057917
BDB057917
|
BDBM50498888
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](Cc3ccccc3)c3cccc(C(C)C)c3)cc12
|
C42H40N2O3 620.793000 |
QHPCWVZZRZXAAW-KDXMTYKHSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498888; PubChem:CID53481933
|
Local ready
Direct docking supported
|
|
E3L057918
BDB057918
|
BDBM50498889
Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccc(-c3ccccc3C(=O)O)cc2)cc1
|
C34H32N2O3 516.641000 |
AEWGUDVDOUFPTB-QHCPKHFHSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498889; PubChem:CID53481932
|
Local ready
Direct docking supported
|
|
E3L057919
BDB057919
|
BDBM50498890
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3ccc(C(C)(C)C)cc3)cc12
|
C37H38N2O3 558.722000 |
WKDKAVKAQXVFJV-DEOSSOPVSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498890; PubChem:CID53389250
|
Local ready
Direct docking supported
|
|
E3L057920
BDB057920
|
BDBM50498891
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](CC(C)C)c3cccc(C(C)C)c3)cc12
|
C39H42N2O3 586.776000 |
KDBITMBUICXATG-BHVANESWSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50498891; PubChem:CID53389252
|
Local ready
Direct docking supported
|