| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L061601
BDB061601
|
BDBM50584191
COc1cc(-c2cc(Sc3nnnn3C)nc(SCc3ccc(Cl)cc3)n2)cc(OC)c1OC
|
C22H21ClN6O3S2 517.036000 |
OHPVOWOEJUHCQM-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584191; PubChem:CID166635461
|
Local ready
Direct docking supported
|
|
E3L061602
BDB061602
|
BDBM50584192
COc1ccc(CNc2nc(Sc3nnnn3C)cc(-c3cc(OC)c(OC)c(OC)c3)n2)cc1
|
C23H25N7O4S 495.565000 |
WWTATIAFYCWPNJ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584192; PubChem:CID166629503
|
Local ready
Direct docking supported
|
|
E3L061603
BDB061603
|
BDBM50584382
O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(S(=O)(=O)N2CCC[C@H]2CN2CCOCC2)cc1
|
C23H27F3N4O4S 512.554000 |
ZPMULUKHFNMJPF-FQEVSTJZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50584382; PubChem:CID135144027
|
Local ready
Direct docking supported
|
|
E3L061604
BDB061604
|
BDBM50584464
CC(C)(Oc1c(Cl)cc(Cn2ncn(-c3ccc(OC(F)(F)F)cc3)c2=O)cc1Cl)C(=O)O
|
C20H16Cl2F3N3O5 506.264000 |
PEISEIBOINEHLD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584464; PubChem:CID166629593
|
Local ready
Direct docking supported
|
|
E3L061605
BDB061605
|
PPARalpha/delta agonist 1
Cc1cc(Cn2ncn(-c3ccc(OC(F)(F)F)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C22H22F3N3O5 465.428000 |
IUEFKAHLCBNPMM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584465; PubChem:CID162423128
|
Local ready
Direct docking supported
|
|
E3L061606
BDB061606
|
BDBM50584466
Cc1cc(Cn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc(C(F)(F)F)c1OC(C)(C)C(=O)O
|
C22H19F6N3O4 503.399000 |
BZFWWXOKSUYPMC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584466; PubChem:CID166627897
|
Local ready
Direct docking supported
|
|
E3L061607
BDB061607
|
BDBM50584467
Cc1cc(Cn2ncn(-c3ccc(C(C)C)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C24H29N3O4 423.513000 |
XFGMWKHGPZNNJR-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584467; PubChem:CID166626106
|
Local ready
Direct docking supported
|
|
E3L061608
BDB061608
|
BDBM50584468
Cc1cc(Cn2ncn(-c3ccc(OC(F)(F)F)cc3)c2=O)cc(Cl)c1OC(C)(C)C(=O)O
|
C21H19ClF3N3O5 485.846000 |
HYKCTJDLYFUROT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584468; PubChem:CID166635584
|
Local ready
Direct docking supported
|
|
E3L061609
BDB061609
|
BDBM50584469
Cc1cc(Cn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc(Cl)c1OC(C)(C)C(=O)O
|
C21H19ClF3N3O4 469.847000 |
UBOFTDCGWGIPEN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584469; PubChem:CID166626018
|
Local ready
Direct docking supported
|
|
E3L061610
BDB061610
|
BDBM50584470
Cc1cc(Cn2ncn(-c3ccc(-c4ccccc4)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C27H27N3O4 457.530000 |
OFRXIISDUHNWSX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584470; PubChem:CID166632603
|
Local ready
Direct docking supported
|
|
E3L061611
BDB061611
|
BDBM50584471
CCc1ccc(-n2cnn(Cc3cc(C)c(OC(C)(C)C(=O)O)c(C)c3)c2=O)cc1
|
C23H27N3O4 409.486000 |
FOHRUUBOCOTEHA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584471; PubChem:CID166630824
|
Local ready
Direct docking supported
|
|
E3L061612
BDB061612
|
BDBM50584472
CC(C)(Oc1c(Cl)cc(Cn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc1Cl)C(=O)O
|
C20H16Cl2F3N3O4 490.265000 |
NOIQPNPAAAKLFH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584472; PubChem:CID166627243
|
Local ready
Direct docking supported
|
|
E3L061613
BDB061613
|
BDBM50584473
Cc1cc(Cn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C22H22F3N3O4 449.429000 |
LKTOCSUOSMHIHM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584473; PubChem:CID166629681
|
Local ready
Direct docking supported
|
|
E3L061614
BDB061614
|
BDBM50584474
CCOc1ccc(-n2cnn(Cc3cc(C)c(OC(C)(C)C(=O)O)c(C)c3)c2=O)cc1
|
C23H27N3O5 425.485000 |
NNJIAXCBCLFQEQ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584474; PubChem:CID166633139
|
Local ready
Direct docking supported
|
|
E3L061615
BDB061615
|
BDBM50584475
Cc1cc(Cn2ncn(-c3ccc(OC(F)(F)F)cc3)c2=O)cc(C(F)(F)F)c1OC(C)(C)C(=O)O
|
C22H19F6N3O5 519.398000 |
DGNSAATWNZSFAE-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584475; PubChem:CID166632176
|
Local ready
Direct docking supported
|
|
E3L061616
BDB061616
|
BDBM50584476
CCc1cc(Cn2ncn(-c3ccc(OC(F)(F)F)cc3)c2=O)cc(CC)c1OC(C)(C)C(=O)O
|
C24H26F3N3O5 493.482000 |
MLGJXSULEWHHOT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584476; PubChem:CID166635363
|
Local ready
Direct docking supported
|
|
E3L061617
BDB061617
|
BDBM50584477
CCc1cc(Cn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc(CC)c1OC(C)(C)C(=O)O
|
C24H26F3N3O4 477.483000 |
DBIJUSHPPNXUIM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584477; PubChem:CID166625971
|
Local ready
Direct docking supported
|
|
E3L061618
BDB061618
|
BDBM50584478
Cc1cc(Cn2ncn(-c3ccc(Br)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C21H22BrN3O4 460.328000 |
JEFBCKUSPLSOEI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584478; PubChem:CID166627893
|
Local ready
Direct docking supported
|
|
E3L061619
BDB061619
|
BDBM50584479
Cc1cc(Cn2ncn(-c3cccc(C(F)(F)F)c3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C22H22F3N3O4 449.429000 |
PVNULZXOFJDBNK-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50584479; PubChem:CID166635692
|
Local ready
Direct docking supported
|
|
E3L061620
BDB061620
|
BDBM50584480
Cc1cc(CCn2ncn(-c3ccc(C(F)(F)F)cc3)c2=O)cc(C)c1OC(C)(C)C(=O)O
|
C23H24F3N3O4 463.456000 |
VVMVYBJXHHXSSH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50584480; PubChem:CID166634885
|
Local ready
Direct docking supported
|