| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063541
BDB063541
|
BDBM50621582
COC(=O)/C=C/CNC(=O)c1cc2c([nH]c1=O)CCC2
|
C14H16N2O4 276.292000 |
OXSXWJOEUNMOPW-ZZXKWVIFSA-N | Q96EP0 | E3 ubiquitin-protein ligase RNF31 |
BindingDB, PubChem
BindingDB:BDBM50621582; PubChem:CID172447054
|
Local ready
Direct docking supported
|
|
E3L063542
BDB063542
|
2-Chloro-N-(4-phenoxyphenyl)acetamide
O=C(CCl)Nc1ccc(Oc2ccccc2)cc1
|
C14H12ClNO2 261.708000 |
PHUZNDQAFGNCRQ-UHFFFAOYSA-N | P78317 | E3 ubiquitin-protein ligase RNF4 |
BindingDB, PubChem
BindingDB:BDBM50621583; PubChem:CID736969
|
Local ready
Direct docking supported
|
|
E3L063543
BDB063543
|
BDBM50621658
CC(=O)N1CC2CCC(C1)N2c1ncc(Cl)c(Nc2ccc3c(c2)c2c(c(=O)n3C)OCC(F)(F)[C@H](C3CC3)N2)n1
|
C28H30ClF2N7O3 586.043000 |
YTUULHQULDBUET-XCNDVJPKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM50621658
|
Local ready
Direct docking supported
|
|
E3L063544
BDB063544
|
BDBM50621659
CC(=O)N1C2CCC1CN(c1ncc(Cl)c(Nc3ccc4c(c3)c3c(c(=O)n4C)OCC(F)(F)[C@H](C4CC4)N3)n1)C2
|
C28H30ClF2N7O3 586.043000 |
YYIQZYNTSIGKMS-XCNDVJPKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM50621659
|
Local ready
Direct docking supported
|
|
E3L063545
BDB063545
|
BDBM50621660
Cn1c(=O)c2c(c3cc(Nc4nc(N5[C@@H]6COC[C@H]5C[C@H](O)C6)ncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C27H29ClF2N6O4 575.016000 |
NSEFNIYZBRIBKB-HGFRQNNFSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM50621660
|
Local ready
Direct docking supported
|
|
E3L063546
BDB063546
|
BDBM50621661
Cn1c(=O)c2c(c3cc(Nc4nc(N5CCC5)ncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C23H23ClF2N6O2 488.926000 |
SMBGAUXQNOXKIW-IBGZPJMESA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621661; PubChem:CID156277180
|
Local ready
Direct docking supported
|
|
E3L063547
BDB063547
|
BDBM50621662
COC1CN(c2ncc(Cl)c(Nc3ccc4c(c3)c3c(c(=O)n4C)OCC(F)(F)[C@H](C4CC4)N3)n2)C1
|
C24H25ClF2N6O3 518.952000 |
GBUBWTJMDIZQJI-FQEVSTJZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621662; PubChem:CID156276659
|
Local ready
Direct docking supported
|
|
E3L063548
BDB063548
|
BDBM50621663
Cn1c(=O)c2c(c3cc(Nc4nc(N5CC(F)(F)C5)ncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C23H21ClF4N6O2 524.906000 |
JNUQAESGHXAITM-SFHVURJKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621663; PubChem:CID156276796
|
Local ready
Direct docking supported
|
|
E3L063549
BDB063549
|
BDBM50621664
Cn1c(=O)c2c(c3cc(Nc4nc(N5CC(C#N)C5)ncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C24H22ClF2N7O2 513.936000 |
VZGLMYCTCYVSQK-FQEVSTJZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621664; PubChem:CID156277196
|
Local ready
Direct docking supported
|
|
E3L063550
BDB063550
|
BDBM50621665
Cn1c(=O)c2c(c3cc(Nc4nc(N5CC(F)C5)ncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C23H22ClF3N6O2 506.916000 |
FCRGNHRJSCJXDA-IBGZPJMESA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621665; PubChem:CID156276669
|
Local ready
Direct docking supported
|
|
E3L063551
BDB063551
|
BDBM50621666
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C21H18Cl2F2N4O2 467.303000 |
IZJMRCTZDBCUHT-SFHVURJKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621666; PubChem:CID156276648
|
Local ready
Direct docking supported
|
|
E3L063552
BDB063552
|
BDBM50621667
Cc1nccc(Nc2ccc3c(c2)c2c(c(=O)n3C)OCC(F)(F)[C@H](C3CC3)N2)c1Cl
|
C22H21ClF2N4O2 446.885000 |
NMCXQPBZVFQDAA-FQEVSTJZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621667; PubChem:CID156276763
|
Local ready
Direct docking supported
|
|
E3L063553
BDB063553
|
BDBM50621668
Cn1c(=O)c2c(c3cc(Nc4ccnc(F)c4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C21H18ClF3N4O2 450.848000 |
MCRHRRIGPAVFNY-SFHVURJKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621668; PubChem:CID156276733
|
Local ready
Direct docking supported
|
|
E3L063554
BDB063554
|
BDBM50621669
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4F)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C21H18ClF3N4O2 450.848000 |
JTJKITJOSCGZOP-SFHVURJKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM50621669; PubChem:CID156276841
|
Local ready
Direct docking supported
|
|
E3L063555
BDB063555
|
BDBM50621710
O=C(O[C@H]1[C@H](OC(=O)c2cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c2)[C@H](OC(=O)c2cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c2)[C@@H](OC(=O)c2cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c2)[C@H](OC(=O)c2cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c2)[C@H]1OC(=O)c1cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c1)c1cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c1
|
C48H36O60S12 1957.560000 |
DGLVLLGQDWLQSC-AZOCGYLKSA-N | P00748 | Coagulation factor XII |
BindingDB
BindingDB:BDBM50621710
|
Local ready
Direct docking supported
|
|
E3L063556
BDB063556
|
BDBM50621751
O=C(O)Cc1ccc(-c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc2)cc1
|
C27H21Cl2NO4 494.374000 |
AJXYOQYFSSSTMZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50621751; PubChem:CID170551899
|
Local ready
Direct docking supported
|
|
E3L063557
BDB063557
|
BDBM50621752
O=C(O)C1(c2cccc(-c3ccc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)cc3)c2)CC1
|
C29H23Cl2NO4 520.412000 |
GFQRXOXNBQDNBC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50621752; PubChem:CID168355560
|
Local ready
Direct docking supported
|
|
E3L063558
BDB063558
|
BDBM50622003
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1cc(C(=O)c2ccccc2)c[nH]1
|
C23H17N3O4 399.406000 |
IARKTIIMKCSZKS-NDENLUEZSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50622003; PubChem:CID172440208
|
Local ready
Direct docking supported
|
|
E3L063559
BDB063559
|
BDBM50622004
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1cc(C(=O)c2ccccc2[N+](=O)[O-])c[nH]1
|
C23H16N4O6 444.403000 |
KOXPUAJSJWZSTB-ODLFYWEKSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50622004; PubChem:CID172471696
|
Local ready
Direct docking supported
|
|
E3L063560
BDB063560
|
BDBM50622006
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1cc(C(=O)c2ccccc2Cl)c[nH]1
|
C23H16ClN3O4 433.851000 |
TWLOTTFBGNKEMS-ODLFYWEKSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50622006; PubChem:CID172470358
|
Local ready
Direct docking supported
|