| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L058001
BDB058001
|
BDBM50500873
Cc1ccc(/N=c2\c3ccc(C)cc3n(C(=O)c3ccc(C(C)(C)C)cc3)c3c(O)c(O)c(O)cc23)cc1
|
C32H30N2O4 506.602000 |
OIVMGNAHDAEBBY-MUGXBBEHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50500873
|
Local ready
Direct docking supported
|
|
E3L058002
BDB058002
|
BDBM50500874
CC(C)c1ccc2/c(=N\c3ccc(Oc4ccccc4)cc3)c3cc(O)c(O)c(O)c3n(C(=O)c3ccc(C(C)(C)C)cc3)c2c1
|
C39H36N2O5 612.726000 |
OHKYOKMELIFONA-QZQBIAJISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50500874
|
Local ready
Direct docking supported
|
|
E3L058003
BDB058003
|
BDBM50500877
C#CCNC(=O)c1ccc(N2N=C(C)/C(=C/c3ccc(-c4cc(C)c(C)cc4[N+](=O)[O-])o3)C2=O)cc1
|
C27H22N4O5 482.496000 |
NPHGQQXLLBUDCN-JCMHNJIXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50500877; PubChem:CID127045845
|
Local ready
Direct docking supported
|
|
E3L058004
BDB058004
|
BDBM50501824
NC(=O)c1cccc2c1O/C(=C\c1ccc(S(=O)(=O)N3CCN(c4ncccn4)CC3)cc1)C2=O
|
C24H21N5O5S 491.529000 |
JUVXHZWXALRTRY-HKWRFOASSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501824; PubChem:CID155527948
|
Local ready
Direct docking supported
|
|
E3L058005
BDB058005
|
BDBM50501825
COc1ccc2[nH]c(CCNC(=O)c3ccc(/C=C4\Oc5c(C(N)=O)cccc5C4=O)cc3)nc2c1
|
C27H22N4O5 482.496000 |
UUKSZBASHWLZEN-XKZIYDEJSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501825; PubChem:CID155553738
|
Local ready
Direct docking supported
|
|
E3L058006
BDB058006
|
BDBM50501826
COC(=O)c1cccc2nc(CCNC(=O)c3ccc(/C=C4\Oc5c(C(N)=O)cccc5C4=O)cc3)[nH]c12
|
C28H22N4O6 510.506000 |
MXASSMDFEIAXPU-STZFKDTASA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501826; PubChem:CID155537475
|
Local ready
Direct docking supported
|
|
E3L058007
BDB058007
|
BDBM50501827
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)N3CCn4c(nnc4C4CC4)C3)cc1)C2=O
|
C25H21N5O4 455.474000 |
JJCAYWVTBMMQMQ-UNOMPAQXSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501827; PubChem:CID138857417
|
Local ready
Direct docking supported
|
|
E3L058008
BDB058008
|
BDBM50501828
Cn1cnc(-c2nnc3n2CCN(C(=O)c2ccc(/C=C4\Oc5c(C(N)=O)cccc5C4=O)cc2)C3)c1
|
C26H21N7O4 495.499000 |
WUSATWKNDGXYRU-JAIQZWGSSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501828; PubChem:CID155566731
|
Local ready
Direct docking supported
|
|
E3L058009
BDB058009
|
BDBM50501829
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)NCCc3nc4c(C(N)=O)cccc4[nH]3)cc1)C2=O
|
C27H21N5O5 495.495000 |
MWUSNBQNIIMQRN-MOSHPQCFSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501829; PubChem:CID155545779
|
Local ready
Direct docking supported
|
|
E3L058010
BDB058010
|
BDBM50501830
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)N3CCn4c(nnc4C(F)(F)F)C3)cc1)C2=O
|
C23H16F3N5O4 483.406000 |
MABHSRSWSCMJOM-YBEGLDIGSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501830; PubChem:CID155541643
|
Local ready
Direct docking supported
|
|
E3L058011
BDB058011
|
BDBM50501831
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)N3CCn4c(CC5CC5)nnc4C3)cc1)C2=O
|
C26H23N5O4 469.501000 |
PGGOMVDSVVGTHN-NDENLUEZSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501831; PubChem:CID155522393
|
Local ready
Direct docking supported
|
|
E3L058012
BDB058012
|
BDBM50501832
Cc1ccc2[nH]c(CCNC(=O)c3ccc(/C=C4\Oc5c(C(N)=O)cccc5C4=O)cc3)nc2c1
|
C27H22N4O4 466.497000 |
YNOAURUBJUTHDB-HMAPJEAMSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501832; PubChem:CID155518636
|
Local ready
Direct docking supported
|
|
E3L058013
BDB058013
|
BDBM50501833
NC(=O)c1cccc2c1O/C(=C\c1ccc(-c3nn[nH]n3)c(F)c1)C2=O
|
C17H10FN5O3 351.297000 |
XYMUVBUGCMKVJH-QPEQYQDCSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501833; PubChem:CID155529239
|
Local ready
Direct docking supported
|
|
E3L058014
BDB058014
|
BDBM50501834
NC(=O)c1cccc2c1O/C(=C\c1ccc(CN3CCN(c4ncccn4)CC3)cc1)C2=O
|
C25H23N5O3 441.491000 |
BVPPYCMTRZYFQG-QNGOZBTKSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501834; PubChem:CID155560098
|
Local ready
Direct docking supported
|
|
E3L058015
BDB058015
|
BDBM50501835
NC(=O)c1cccc2c1O/C(=C\c1ccc(-c3nn[nH]n3)cc1)C2=O
|
C17H11N5O3 333.307000 |
QYXDDRWHQGGYKR-JYRVWZFOSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501835; PubChem:CID155524058
|
Local ready
Direct docking supported
|
|
E3L058016
BDB058016
|
BDBM50501836
COc1cc(-c2nn[nH]n2)ccc1/C=C1\Oc2c(C(N)=O)cccc2C1=O
|
C18H13N5O4 363.333000 |
UNIBAROCFQUNJP-AUWJEWJLSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501836; PubChem:CID155541447
|
Local ready
Direct docking supported
|
|
E3L058017
BDB058017
|
BDBM50501837
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)N3CCN(c4ncncn4)CC3)cc1)C2=O
|
C24H20N6O4 456.462000 |
KJYORNXVEFBFIU-UNOMPAQXSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501837; PubChem:CID155533875
|
Local ready
Direct docking supported
|
|
E3L058018
BDB058018
|
BDBM50501838
NC(=O)c1cccc2c1O/C(=C\c1cccc(C(=O)N3CCN(c4ncccn4)CC3)c1)C2=O
|
C25H21N5O4 455.474000 |
ZNPIDBLWNIOEOK-HKWRFOASSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501838; PubChem:CID155512592
|
Local ready
Direct docking supported
|
|
E3L058019
BDB058019
|
BDBM50501839
NC(=O)c1cccc2c1O/C(=C\c1ccc(N3CCN(c4ncccn4)CC3)cc1)C2=O
|
C24H21N5O3 427.464000 |
ZFNHGEZMVBWGNY-HKWRFOASSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501839; PubChem:CID155514140
|
Local ready
Direct docking supported
|
|
E3L058020
BDB058020
|
BDBM50501840
NC(=O)c1cccc2c1O/C(=C\c1ccc(C(=O)N3CCN(c4ncccn4)CC3)cc1)C2=O
|
C25H21N5O4 455.474000 |
FNXDYTIQYSVRMD-HKWRFOASSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50501840; PubChem:CID155568616
|
Local ready
Direct docking supported
|