| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L049161
BDB049161
|
BDBM50234692
O=C(O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccc(Cl)cc1)c1nnnn1Cc1ccc(Cl)cc1
|
C25H19Cl3N6O2 541.826000 |
KFCWUSMXFROILL-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234692; PubChem:CID137655549
|
Local ready
Direct docking supported
|
|
E3L049162
BDB049162
|
BDBM50234693
CC(C)c1ccc(-n2nnnc2C(NCC2CCCCC2)c2c(C(=O)O)[nH]c3cc(Cl)ccc23)cc1
|
C27H31ClN6O2 507.038000 |
YNOYOVAHFMDVDF-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234693; PubChem:CID137645566
|
Local ready
Direct docking supported
|
|
E3L049163
BDB049163
|
BDBM50234694
O=C(O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCC1)c1nnnn1-c1cccc(Oc2ccccc2)c1
|
C29H27ClN6O3 543.027000 |
VBBBINIGZGMQJY-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234694; PubChem:CID137649150
|
Local ready
Direct docking supported
|
|
E3L049164
BDB049164
|
BDBM50234695
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(OCc2ccccc2F)cc1
|
C34H36ClFN6O3 631.152000 |
TXXXBOUIDRPXRE-UHFFFAOYSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50234695; PubChem:CID137633360
|
Local ready
Direct docking supported
|
|
E3L049165
BDB049165
|
BDBM50234696
CCCCCNC(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)c1nnnn1Cc1ccc(OCc2ccccc2Br)cc1
|
C30H30BrClN6O3 637.966000 |
BFKBNEAKERECKC-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234696; PubChem:CID137651734
|
Local ready
Direct docking supported
|
|
E3L049166
BDB049166
|
BDBM50234697
CCCCCNC(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)c1nnnn1Cc1ccc(OCc2ccccc2Cl)cc1
|
C30H30Cl2N6O3 593.515000 |
SYKXNHHLQVLQAQ-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234697; PubChem:CID137638070
|
Local ready
Direct docking supported
|
|
E3L049167
BDB049167
|
BDBM50234698
O=C(O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(OCc2ccc(Br)cc2)cc1
|
C31H30BrClN6O3 649.977000 |
CAPPOVCTBGRMBC-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234698; PubChem:CID137641354
|
Local ready
Direct docking supported
|
|
E3L049168
BDB049168
|
BDBM50234699
CCCCCNC(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)c1nnnn1-c1ccc(OCc2ccccc2Br)cc1
|
C29H28BrClN6O3 623.939000 |
VPPUTUBGIUQPRD-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234699; PubChem:CID137658988
|
Local ready
Direct docking supported
|
|
E3L049169
BDB049169
|
BDBM50234700
O=C(O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCCC1)c1nnnn1-c1cccc(OCc2ccccc2)c1
|
C31H31ClN6O3 571.081000 |
HJIBNGCUBFYPMB-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50234700; PubChem:CID137637822
|
Local ready
Direct docking supported
|
|
E3L049170
BDB049170
|
BDBM50234915
Cc1cccc2c(=O)[nH]c(CCC(=O)Nc3ccc(C(=O)Nc4cccc5cccnc45)cc3)nc12
|
C28H23N5O3 477.524000 |
VADYPHREEXKWAX-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234915; PubChem:CID135567126
|
Local ready
Direct docking supported
|
|
E3L049171
BDB049171
|
BDBM50234916
O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1ccc(C(=O)Nc2cccc3cccnc23)cc1
|
C27H21N5O3 463.497000 |
HILQRGHXDPSDBM-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234916; PubChem:CID135567125
|
Local ready
Direct docking supported
|
|
E3L049172
BDB049172
|
3-(8-methyl-4-oxo-3H-quinazolin-2-yl)propanoic acid
Cc1cccc2c(=O)[nH]c(CCC(=O)O)nc12
|
C12H12N2O3 232.239000 |
OOIMOZIUYZYXLA-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234917; PubChem:CID136404917
|
Local ready
Direct docking supported
|
|
E3L049173
BDB049173
|
4-amino-N-(quinolin-8-yl)benzamide
Nc1ccc(C(=O)Nc2cccc3cccnc23)cc1
|
C16H13N3O 263.300000 |
BUBAMNUHSKQIEN-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234918; PubChem:CID6490174
|
Local ready
Direct docking supported
|
|
E3L049174
BDB049174
|
BDBM50234919
O=C(Nc1cccc2cccnc12)c1ccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H](C4)[C@@H]3C2=O)cc1
|
C25H21N3O3 411.461000 |
LFGACFGWTJMDPZ-ALFLXDJESA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234919; PubChem:CID56587957
|
Local ready
Direct docking supported
|
|
E3L049175
BDB049175
|
BDBM50234921
O=C1SCCc2nc(-c3ccc(C(F)(F)F)cc3)[nH]c(=O)c21
|
C14H9F3N2O2S 326.299000 |
YAAIOGGCMLWOPM-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234921; PubChem:CID137637696
|
Local ready
Direct docking supported
|
|
E3L049176
BDB049176
|
3-(4-Oxo-3,4-dihydro-quinazolin-2-yl)-propionic acid
O=C(O)CCc1nc(O)c2ccccc2n1
|
C11H10N2O3 218.212000 |
HYSISEGNFBAVMJ-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50234922; PubChem:CID135449434
|
Local ready
Direct docking supported
|
|
E3L049177
BDB049177
|
Gsk4027
CN1C[C@H](Nc2cnn(C)c(=O)c2Br)C[C@H](c2ccccc2)C1
|
C17H21BrN4O 377.286000 |
VZAFGXCWAWRULT-UONOGXRCSA-N | Q12830, Q92831 | Histone acetyltransferase KAT2B, Nucleosome-remodeling factor subunit BPTF |
BindingDB, PubChem
BindingDB:BDBM50234923; PubChem:CID126961735
|
Local ready
Direct docking supported
|
|
E3L049178
BDB049178
|
4-Chloro-2-methyl-5-(phenylamino)pyridazin-3(2H)-one
Cn1ncc(Nc2ccccc2)c(Cl)c1=O
|
C11H10ClN3O 235.674000 |
DWVFDRCVLQRHME-UHFFFAOYSA-N | Q12830, Q92831 | Histone acetyltransferase KAT2B, Nucleosome-remodeling factor subunit BPTF |
BindingDB, PubChem
BindingDB:BDBM50234924; PubChem:CID137634095
|
Local ready
Direct docking supported
|
|
E3L049179
BDB049179
|
4-Chloro-2-methyl-5-(3-methylanilino)pyridazin-3-one
Cc1cccc(Nc2cnn(C)c(=O)c2Cl)c1
|
C12H12ClN3O 249.701000 |
NFUYTCBSSVZVDF-UHFFFAOYSA-N | Q92831 | Histone acetyltransferase KAT2B |
BindingDB, PubChem
BindingDB:BDBM50234925; PubChem:CID137654127
|
Local ready
Direct docking supported
|
|
E3L049180
BDB049180
|
BDBM50234926
CN1CCc2c(cccc2Nc2cnn(C)c(=O)c2Cl)C1
|
C15H17ClN4O 304.781000 |
YJJYUKCKKSVTAG-UHFFFAOYSA-N | Q92831 | Histone acetyltransferase KAT2B |
BindingDB, PubChem
BindingDB:BDBM50234926; PubChem:CID131953422
|
Local ready
Direct docking supported
|