| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L045461
BDB045461
|
(Z)-N-(3-carbamoylphenyl)-N',N'-diethylbut-2-enediamide
CCN(CC)C(=O)/C=C\C(=O)Nc1cccc(C(N)=O)c1
|
C15H19N3O3 289.335000 |
GXRXZUZPHAEMRS-HJWRWDBZSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079621; PubChem:CID118732825
|
Local ready
Direct docking supported
|
|
E3L045462
BDB045462
|
BDBM50079622
NC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCCC2)c1
|
C15H17N3O3 287.319000 |
DDKHNAWVXVRNGN-SREVYHEPSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079622; PubChem:CID118732824
|
Local ready
Direct docking supported
|
|
E3L045463
BDB045463
|
(E)-N'-(3-carbamoylphenyl)-N-methylbut-2-enediamide
CNC(=O)/C=C/C(=O)Nc1cccc(C(N)=O)c1
|
C12H13N3O3 247.254000 |
FYQRBLGGKLIYRQ-AATRIKPKSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079623; PubChem:CID118732823
|
Local ready
Direct docking supported
|
|
E3L045464
BDB045464
|
Artd10/parp10-IN-2
CNC(=O)/C=C\C(=O)Nc1cccc(C(N)=O)c1
|
C12H13N3O3 247.254000 |
FYQRBLGGKLIYRQ-WAYWQWQTSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079624; PubChem:CID118732822
|
Local ready
Direct docking supported
|
|
E3L045465
BDB045465
|
5-(3-Carbamoylanilino)-5-oxopentanoic acid
NC(=O)c1cccc(NC(=O)CCCC(=O)O)c1
|
C12H14N2O4 250.254000 |
HPBCPSNBTRKOJM-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079625; PubChem:CID26160509
|
Local ready
Direct docking supported
|
|
E3L045466
BDB045466
|
3-(3,4-Dimethyl-2,5-dioxopyrrol-1-yl)benzamide
CC1=C(C)C(=O)N(c2cccc(C(N)=O)c2)C1=O
|
C13H12N2O3 244.250000 |
DWVKVUXOQWIDLK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079626; PubChem:CID118732821
|
Local ready
Direct docking supported
|
|
E3L045467
BDB045467
|
BDBM50079627
NC(=O)c1cccc(NC(=O)C2=C(C(=O)O)CCC2)c1
|
C14H14N2O4 274.276000 |
FDQXEDMRIBACLZ-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079627; PubChem:CID118732820
|
Local ready
Direct docking supported
|
|
E3L045468
BDB045468
|
BDBM50079628
NC(=O)c1cccc(NC(=O)C2CC2C(=O)O)c1
|
C12H12N2O4 248.238000 |
RHPADPRZKCJXCF-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079628; PubChem:CID60792847
|
Local ready
Direct docking supported
|
|
E3L045469
BDB045469
|
(Z)-4-(4-carbamoylanilino)-4-oxobut-2-enoic acid
NC(=O)c1ccc(NC(=O)/C=C\C(=O)O)cc1
|
C11H10N2O4 234.211000 |
PDXYZWLCNNSKBX-WAYWQWQTSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079629; PubChem:CID2106442
|
Local ready
Direct docking supported
|
|
E3L045470
BDB045470
|
BDBM50079630
Cc1ccc(C(N)=O)cc1NC(=O)/C=C\C(=O)O
|
C12H12N2O4 248.238000 |
IZYWDHWSSJLIAL-PLNGDYQASA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079630; PubChem:CID118732815
|
Local ready
Direct docking supported
|
|
E3L045471
BDB045471
|
BDBM50079635
COc1ccc(C(N)=O)cc1NC(=O)/C=C\C(=O)O
|
C12H12N2O5 264.237000 |
BHTWOIYWJWZADO-PLNGDYQASA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50079635; PubChem:CID118732816
|
Local ready
Direct docking supported
|
|
E3L045472
BDB045472
|
1,5-diphenyl-1H-pyrazole-3-carboxylic acid
O=C(O)c1cc(-c2ccccc2)n(-c2ccccc2)n1
|
C16H12N2O2 264.284000 |
JJMZLVASVSISLC-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50080819; PubChem:CID869152
|
Local ready
Direct docking supported
|
|
E3L045473
BDB045473
|
BDBM50081125
[C]c1cc([O])cc([C])c1[C]=C1C(=O)N([C]c2ccccc2)C(=O)N([C]c2ccccc2)C1=O
|
C27H12N2O4 428.403000 |
XGHXAGQFEUXHEA-UHFFFAOYSA-N | Q09472, Q92793 | Histone acetyltransferase p300, CREB-binding protein |
BindingDB
BindingDB:BDBM50081125
|
Local ready
Direct docking supported
|
|
E3L045474
BDB045474
|
BDBM50081159
[O]c1ccc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)cc1
|
C25H14N2O4 406.397000 |
COTVZVWJPQWQBQ-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081159
|
Local ready
Direct docking supported
|
|
E3L045475
BDB045475
|
BDBM50081160
[O]c1ccc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)cc1[O]
|
C25H13N2O5 421.388000 |
XLNHKAKQVDMZCZ-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081160
|
Local ready
Direct docking supported
|
|
E3L045476
BDB045476
|
BDBM50081161
[C]Oc1ccc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)cc1[O]
|
C26H13N2O5 433.399000 |
DMXTULYDGCNETD-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081161
|
Local ready
Direct docking supported
|
|
E3L045477
BDB045477
|
BDBM50081162
[C]Oc1cc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)ccc1[O]
|
C26H13N2O5 433.399000 |
VIYWKONNRHFYPN-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081162
|
Local ready
Direct docking supported
|
|
E3L045478
BDB045478
|
BDBM50081163
[C]Oc1ccc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)cc1O[C]
|
C27H13N2O5 445.410000 |
QZCHHTVBAULDQK-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081163
|
Local ready
Direct docking supported
|
|
E3L045479
BDB045479
|
BDBM50081164
[C]Oc1ccc([C]=C2C(=O)N([C]c3ccccc3)C(=O)N([C]c3ccccc3)C2=O)cc1
|
C26H14N2O4 418.408000 |
BGNZEZMIHQOWBV-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081164
|
Local ready
Direct docking supported
|
|
E3L045480
BDB045480
|
BDBM50081165
[C][C]([C])[C]N1C(=O)C(=[C]c2ccc([O])cc2)C(=O)N([C][C]([C])[C])C1=O
|
C19H4N2O4 324.251000 |
HWBQMPDOHHFBGJ-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB
BindingDB:BDBM50081165
|
Local ready
Direct docking supported
|