| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L064721
BDB064721
|
BDBM50638266
CCCS(=O)(=O)Oc1c(Br)cc(-c2nc3c(C(N)=O)cccc3[nH]2)cc1OC
|
C18H18BrN3O5S 468.329000 |
ADRLWUFSRZSWAB-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50638266; PubChem:CID175450834
|
Local ready
Direct docking supported
|
|
E3L064722
BDB064722
|
Parp-1-IN-23
COc1cc(-c2nc3c(C(N)=O)cccc3[nH]2)cc(Br)c1OS(=O)(=O)c1ccccc1C
|
C22H18BrN3O5S 516.373000 |
FWZXLBLAODSAKH-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50638267; PubChem:CID172638530
|
Local ready
Direct docking supported
|
|
E3L064723
BDB064723
|
BDBM50638268
COc1cc(-c2nc3c(C(N)=O)cccc3[nH]2)cc(Br)c1OS(=O)(=O)c1c(C)cc(C)cc1C
|
C24H22BrN3O5S 544.427000 |
GLEGMISPFJWWOQ-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50638268; PubChem:CID175450845
|
Local ready
Direct docking supported
|
|
E3L064724
BDB064724
|
BDBM50638387
CC(=O)c1cc(C(=O)Nc2cc(CO)cc(-c3cnn(C)c3)c2F)c2cc(OCCCCCC(=O)NCCCc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)ccn12
|
C44H44FN7O9 833.874000 |
VVOJECSTVKGBLZ-UHFFFAOYSA-N | Q09472, Q92793, Q96SW2 | CREB-binding protein, Histone acetyltransferase p300, Protein cereblon |
BindingDB
BindingDB:BDBM50638387
|
Local ready
Direct docking supported
|
|
E3L064725
BDB064725
|
BDBM50638388
CC(=O)c1cc(C(=O)Nc2cc(CO)cc(-c3cnn(C)c3)c2F)c2cc(OCCCCC(=O)NCCCc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)ccn12
|
C43H42FN7O9 819.847000 |
SVADXQXVQIZUOT-UHFFFAOYSA-N | Q09472, Q92793, Q96SW2 | Histone acetyltransferase p300, Protein cereblon, CREB-binding protein |
BindingDB
BindingDB:BDBM50638388
|
Local ready
Direct docking supported
|
|
E3L064726
BDB064726
|
BDBM50638389
CC(=O)c1cc(C(=O)Nc2cc(CO)cc(-c3cnn(C)c3)c2F)c2cc(OCCCCCCC(=O)NCCCc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)ccn12
|
C45H46FN7O9 847.901000 |
FQVXPGXSEMNATG-UHFFFAOYSA-N | Q09472, Q92793, Q96SW2 | Protein cereblon, Histone acetyltransferase p300, CREB-binding protein |
BindingDB
BindingDB:BDBM50638389
|
Local ready
Direct docking supported
|
|
E3L064727
BDB064727
|
BDBM50638390
CC(=O)c1cc(C(=O)Nc2cc(CO)cc(-c3cnn(C)c3)c2F)c2cc(OCC(=O)NCCCCNc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)ccn12
|
C41H39FN8O9 806.808000 |
IQZLAXNGIATBBF-UHFFFAOYSA-N | Q09472, Q92793, Q96SW2 | CREB-binding protein, Histone acetyltransferase p300, Protein cereblon |
BindingDB
BindingDB:BDBM50638390
|
Local ready
Direct docking supported
|
|
E3L064728
BDB064728
|
BDBM50638391
CC(=O)c1cc(C(=O)Nc2cc(CO)cc(-c3cnn(C)c3)c2F)c2cc(OCCCC(=O)NCCNc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)ccn12
|
C41H39FN8O9 806.808000 |
RFOWAAZLTHLZHO-UHFFFAOYSA-N | Q09472, Q92793, Q96SW2 | CREB-binding protein, Protein cereblon, Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50638391
|
Local ready
Direct docking supported
|
|
E3L064729
BDB064729
|
BDBM50638606
CCn1ncc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3ccc(Cc4nc5c(C(N)=O)cccc5[nH]4)cc3)cc21
|
C33H31N7O3 573.657000 |
CHXQYSSALOBPEV-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50638606; PubChem:CID170557614
|
Local ready
Direct docking supported
|
|
E3L064730
BDB064730
|
Parp/ezh2-IN-2
Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(-c4nc5c(C(N)=O)cccc5[nH]4)cc3)cc3c2cnn3C(C)C)c(=O)[nH]1
|
C33H31N7O3 573.657000 |
QCDZWDMYQRCVLA-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50638607; PubChem:CID169494373
|
Local ready
Direct docking supported
|
|
E3L064731
BDB064731
|
BDBM50638678
Oc1cc(O)cc(/C=C/c2ccc(O)cc2-c2ccoc2)c1
|
C18H14O4 294.306000 |
YQRXVWVHTXKXCR-OWOJBTEDSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638678; PubChem:CID177376054
|
Local ready
Direct docking supported
|
|
E3L064732
BDB064732
|
BDBM50638679
Oc1cc(O)cc(/C=C/c2ccc(O)cc2-c2ccsc2)c1
|
C18H14O3S 310.374000 |
VHWZULQJVNOBJE-OWOJBTEDSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638679; PubChem:CID177376055
|
Local ready
Direct docking supported
|
|
E3L064733
BDB064733
|
BDBM50638680
Oc1cc(O)cc(/C=C/c2ccc(O)cc2-c2ccccc2)c1
|
C20H16O3 304.345000 |
SRLWWKNHFQXNKI-VOTSOKGWSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638680; PubChem:CID177376056
|
Local ready
Direct docking supported
|
|
E3L064734
BDB064734
|
BDBM50638681
Oc1cc(O)cc(/C=C/c2ccc(O)cc2-c2cccc(O)c2)c1
|
C20H16O4 320.344000 |
ZRDBIQPVFKOXIG-SNAWJCMRSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638681; PubChem:CID177376057
|
Local ready
Direct docking supported
|
|
E3L064735
BDB064735
|
BDBM50638682
Oc1ccc(-c2cc(O)ccc2/C=C/c2cc(O)cc(O)c2)cc1
|
C20H16O4 320.344000 |
HYISBJACILIUNE-OWOJBTEDSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638682; PubChem:CID177376058
|
Local ready
Direct docking supported
|
|
E3L064736
BDB064736
|
BDBM50638683
O=[N+]([O-])c1cccc(-c2cc(O)ccc2/C=C/c2cc(O)cc(O)c2)c1
|
C20H15NO5 349.342000 |
HDPRICZISHHTMH-SNAWJCMRSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638683; PubChem:CID177376059
|
Local ready
Direct docking supported
|
|
E3L064737
BDB064737
|
BDBM50638684
NC(=O)/C=C/c1cc(O)ccc1/C=C/c1cc(O)cc(O)c1
|
C17H15NO4 297.310000 |
PLODZAUEAYITNE-ZMVSMXTFSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638684; PubChem:CID177376060
|
Local ready
Direct docking supported
|
|
E3L064738
BDB064738
|
BDBM50638685
CNC(=O)/C=C/c1cc(O)ccc1/C=C/c1cc(O)cc(O)c1
|
C18H17NO4 311.337000 |
ZAGLLJXDSACOGW-QGZVWANCSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638685; PubChem:CID177376061
|
Local ready
Direct docking supported
|
|
E3L064739
BDB064739
|
BDBM50638686
CCCNC(=O)/C=C/c1cc(O)ccc1/C=C/c1cc(O)cc(O)c1
|
C20H21NO4 339.391000 |
VVXJTIUQTMVOHH-PBOULFJWSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638686; PubChem:CID177376062
|
Local ready
Direct docking supported
|
|
E3L064740
BDB064740
|
BDBM50638687
CN(C)C(=O)/C=C/c1cc(O)ccc1/C=C/c1cc(O)cc(O)c1
|
C19H19NO4 325.364000 |
YJFASSNJKSQWDV-PBOULFJWSA-N | Q96FA3 | E3 ubiquitin-protein ligase pellino homolog 1 |
BindingDB, PubChem
BindingDB:BDBM50638687; PubChem:CID177376063
|
Local ready
Direct docking supported
|