| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L061961
BDB061961
|
BDBM50591455
Cc1ccccc1-c1nc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)ccc2o1
|
C21H14ClN3O4 407.813000 |
IDWYUAHXLFZWBU-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591455; PubChem:CID16003684
|
Local ready
Direct docking supported
|
|
E3L061962
BDB061962
|
BDBM50591456
CCc1ccc(-c2nc3cc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3o2)cc1
|
C22H16ClN3O4 421.840000 |
WFEBALYYDASKIV-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50591456; PubChem:CID1370177
|
Local ready
Direct docking supported
|
|
E3L061963
BDB061963
|
BDBM50591457
O=C(Nc1ccc2oc(-c3cccc(Cl)c3)nc2c1)c1cc([N+](=O)[O-])ccc1Cl
|
C20H11Cl2N3O4 428.231000 |
AYHACFSFXKCYBD-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591457; PubChem:CID16000403
|
Local ready
Direct docking supported
|
|
E3L061964
BDB061964
|
BDBM50591458
O=C(Nc1ccc2oc(-c3ccccc3Br)nc2c1)c1cc([N+](=O)[O-])ccc1Cl
|
C20H11BrClN3O4 472.682000 |
HFZZOFWNFNPCTR-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591458; PubChem:CID1369941
|
Local ready
Direct docking supported
|
|
E3L061965
BDB061965
|
BDBM50591459
COc1ccc(-c2nc3cc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3o2)cc1F
|
C21H13ClFN3O5 441.802000 |
RKMDRKRDEJNITB-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591459; PubChem:CID168272258
|
Local ready
Direct docking supported
|
|
E3L061966
BDB061966
|
BDBM50591460
Cc1cncc(-c2nc3cc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3o2)c1
|
C20H13ClN4O4 408.801000 |
KKPYIJHVCRZNMX-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591460; PubChem:CID168286941
|
Local ready
Direct docking supported
|
|
E3L061967
BDB061967
|
BDBM50591461
CCc1ccc(-c2nc3cc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3o2)cn1
|
C21H15ClN4O4 422.828000 |
DBWUUVVUXKTOAW-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591461; PubChem:CID168295652
|
Local ready
Direct docking supported
|
|
E3L061968
BDB061968
|
BDBM50591462
Cc1ccc(-c2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3o2)cc1
|
C21H14ClN3O4 407.813000 |
KMRUISWZUWQWLJ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591462; PubChem:CID168281661
|
Local ready
Direct docking supported
|
|
E3L061969
BDB061969
|
BDBM50591463
CCc1ccc(-c2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3n2C)cc1
|
C23H19ClN4O3 434.883000 |
MHEJOGKKTNUSDE-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591463; PubChem:CID168291172
|
Local ready
Direct docking supported
|
|
E3L061970
BDB061970
|
BDBM50591464
CCc1ccc(-c2nc3cc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3n2C)cc1
|
C23H19ClN4O3 434.883000 |
XRQPGICIGLQHJP-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591464; PubChem:CID168281292
|
Local ready
Direct docking supported
|
|
E3L061971
BDB061971
|
BDBM50591465
O=C(Nc1ccc2nc(-c3ccccc3)cn2c1)c1cc([N+](=O)[O-])ccc1Cl
|
C20H13ClN4O3 392.802000 |
OLNLDXSACNANEG-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591465; PubChem:CID168290882
|
Local ready
Direct docking supported
|
|
E3L061972
BDB061972
|
BDBM50591466
Cc1ccc(-n2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3n2)cc1
|
C20H14ClN5O3 407.817000 |
XGSIQFITHSRNIR-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591466; PubChem:CID1372049
|
Local ready
Direct docking supported
|
|
E3L061973
BDB061973
|
BDBM50591467
CCc1ccc(-c2nc3cc(NS(=O)(=O)c4cc([N+](=O)[O-])ccc4Cl)ccc3o2)cc1
|
C21H16ClN3O5S 457.895000 |
BZZJAVJGFQVBLK-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591467; PubChem:CID4567015
|
Local ready
Direct docking supported
|
|
E3L061974
BDB061974
|
BDBM50591468
Cc1cc2nc(-c3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)oc2cc1C
|
C22H16ClN3O4 421.840000 |
WAZYUDWPQWJPCQ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591468; PubChem:CID1365378
|
Local ready
Direct docking supported
|
|
E3L061975
BDB061975
|
BDBM50591469
CCc1ccc2oc(-c3cccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)c3)nc2c1
|
C22H16ClN3O4 421.840000 |
QQKBNZFZFOSTFD-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591469; PubChem:CID1365274
|
Local ready
Direct docking supported
|
|
E3L061976
BDB061976
|
BDBM50591470
CCc1ccc(-c2nc3cc(NC(=O)c4cc(C(F)(F)F)ccc4Cl)ccc3o2)cc1
|
C23H16ClF3N2O2 444.840000 |
HXPHKLYYLDGHDG-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591470; PubChem:CID168291372
|
Local ready
Direct docking supported
|
|
E3L061977
BDB061977
|
BDBM50591471
CCc1ccc(-c2nc3cc(NC(=O)c4cc(C(=O)NC)ccc4Cl)ccc3o2)cc1
|
C24H20ClN3O3 433.895000 |
NNWJERBJLLVTRW-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591471; PubChem:CID168292757
|
Local ready
Direct docking supported
|
|
E3L061978
BDB061978
|
BDBM50591472
CCc1ccc(-c2nc3cc(NC(=O)c4cccnc4Cl)ccc3o2)cc1
|
C21H16ClN3O2 377.831000 |
ZFQQEMGUPNBEDY-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591472; PubChem:CID125636089
|
Local ready
Direct docking supported
|
|
E3L061979
BDB061979
|
BDBM50591473
CCc1ccc(-c2nc3cc(NC(=O)c4cc(C#N)ccc4Cl)ccc3o2)cc1
|
C23H16ClN3O2 401.853000 |
RJMOMHQUHNNXHP-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591473; PubChem:CID168276021
|
Local ready
Direct docking supported
|
|
E3L061980
BDB061980
|
BDBM50591474
CCc1ccc(-c2nc3cc(NC(=O)c4cccc([N+](=O)[O-])c4)ccc3o2)cc1
|
C22H17N3O4 387.395000 |
ALDLRFRHDGPXCC-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50591474; PubChem:CID1101514
|
Local ready
Direct docking supported
|