| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L043981
BDB043981
|
BDBM50018538
CC(C)OC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2ccc(C(F)(F)F)cc2F)C1=O
|
C28H22BrF4NO3 576.384000 |
LEKHCXIJMKPRPS-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018538; PubChem:CID90644130
|
Local ready
Direct docking supported
|
|
E3L043982
BDB043982
|
BDBM50018539
CC(C)OC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2ccc(C(F)(F)F)cc2)C1=O
|
C28H23BrF3NO3 558.394000 |
PJAPWIDTOIAQFH-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018539; PubChem:CID90644131
|
Local ready
Direct docking supported
|
|
E3L043983
BDB043983
|
BDBM50018540
CC(C)OC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2cccnc2)C1=O
|
C26H23BrN2O3 491.385000 |
SSZOKBDMSNYVDF-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018540; PubChem:CID90644132
|
Local ready
Direct docking supported
|
|
E3L043984
BDB043984
|
BDBM50018541
CC(C)OC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(CCCn2ccnc2)C1=O
|
C26H26BrN3O3 508.416000 |
NRGBWBGUOGGUIL-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018541; PubChem:CID71453812
|
Local ready
Direct docking supported
|
|
E3L043985
BDB043985
|
BDBM50018542
C[C@@H](NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2ccc(C(F)(F)F)cc2OC(C)(C)C)C1=O)c1ccccc1
|
C37H34BrF3N2O3 691.588000 |
PPGGNZSFJSHNAB-PXWGLLCJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018542; PubChem:CID90644133
|
Local ready
Direct docking supported
|
|
E3L043986
BDB043986
|
BDBM50018543
CC(C)Oc1cc(C(F)(F)F)ccc1CN1C(=O)C(N[C@H](C)c2ccccc2)=C(C(=O)c2ccccc2)C1c1ccc(Br)cc1
|
C36H32BrF3N2O3 677.561000 |
ZZVXQCTUOUEHOG-PXWGLLCJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018543; PubChem:CID86298586
|
Local ready
Direct docking supported
|
|
E3L043987
BDB043987
|
BDBM50018547
CCOc1cc(C(F)(F)F)ccc1CN1C(=O)C(N[C@H](C)c2ccccc2)=C(C(=O)c2ccccc2)C1c1ccc(Br)cc1
|
C35H30BrF3N2O3 663.534000 |
LMPJGYWUFPAMMB-GFTAOQHMSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018547; PubChem:CID90644134
|
Local ready
Direct docking supported
|
|
E3L043988
BDB043988
|
BDBM50018548
COc1cc(C(F)(F)F)ccc1CN1C(=O)C(N[C@H](C)c2ccccc2)=C(C(=O)c2ccccc2)C1c1ccc(Br)cc1
|
C34H28BrF3N2O3 649.507000 |
GFVBMLCFPUXLPM-UBIBJYAGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018548; PubChem:CID90644135
|
Local ready
Direct docking supported
|
|
E3L043989
BDB043989
|
BDBM50018549
C[C@@H](NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2ccc(C(F)(F)F)cc2F)C1=O)c1ccccc1
|
C33H25BrF4N2O2 637.471000 |
UIDYYYMYPYUWNE-UEWHNOOISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018549; PubChem:CID90644136
|
Local ready
Direct docking supported
|
|
E3L043990
BDB043990
|
BDBM50018552
C[C@@H](NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1
|
C33H26BrF3N2O2 619.481000 |
BIHOXSFRMNVXGX-BPADPFCFSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018552; PubChem:CID90644137
|
Local ready
Direct docking supported
|
|
E3L043991
BDB043991
|
BDBM50018554
C[C@@H](NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(Cc2cccnc2)C1=O)c1ccccc1
|
C31H26BrN3O2 552.472000 |
KQYDPVOKMJJFAX-QYWNIODHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018554; PubChem:CID86298587
|
Local ready
Direct docking supported
|
|
E3L043992
BDB043992
|
BDBM50018555
C[C@@H](NC1=C(C(=O)c2ccccc2)C(c2ccc(Br)cc2)N(CCCn2ccnc2)C1=O)c1ccccc1
|
C31H29BrN4O2 569.503000 |
VNRNRYHDZHHYIZ-DMDVIOLWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50018555; PubChem:CID90644138
|
Local ready
Direct docking supported
|
|
E3L043993
BDB043993
|
BDBM50018698
Cn1c(C(=O)NCCN2CCCC2)cc2c1-c1ccccc1C(=O)NC2
|
C20H24N4O2 352.438000 |
CYLSSHZFVCERHB-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018698; PubChem:CID90644171
|
Local ready
Direct docking supported
|
|
E3L043994
BDB043994
|
BDBM50018699
Cc1c(C(=O)N2CCN(C)CC2)sc2c1[nH]c(=O)c1ccccc12
|
C18H19N3O2S 341.436000 |
NLQWKCUCXRLTEV-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018699; PubChem:CID90644172
|
Local ready
Direct docking supported
|
|
E3L043995
BDB043995
|
BDBM50018700
CCN1CCN(C(=O)c2sc3c([nH]c(=O)c4ccccc43)c2C)CC1
|
C19H21N3O2S 355.463000 |
WXFGNEQQWVQXJG-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018700; PubChem:CID86298603
|
Local ready
Direct docking supported
|
|
E3L043996
BDB043996
|
BDBM50018701
Cc1c(C(=O)N2CCN(C(C)C)CC2)sc2c1[nH]c(=O)c1ccccc12
|
C20H23N3O2S 369.490000 |
OOXIMZVAIVZRCI-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018701; PubChem:CID86298604
|
Local ready
Direct docking supported
|
|
E3L043997
BDB043997
|
BDBM50018702
Cc1c(C(=O)N2CCC(N(C)C)CC2)sc2c1[nH]c(=O)c1ccccc12
|
C20H23N3O2S 369.490000 |
HXFCZVDLWKIFFO-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018702; PubChem:CID86298605
|
Local ready
Direct docking supported
|
|
E3L043998
BDB043998
|
BDBM50018703
Cc1c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)sc2c1[nH]c(=O)c1ccccc12
|
C24H19FN2O2S 418.493000 |
QSUKOXOCHHQXGS-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018703; PubChem:CID90644173
|
Local ready
Direct docking supported
|
|
E3L043999
BDB043999
|
BDBM50018704
Cc1c(C(=O)NCCN2CCN(C)CC2)sc2c1[nH]c(=O)c1ccccc12
|
C20H24N4O2S 384.505000 |
YJWMLUVDPMSGOQ-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018704; PubChem:CID90644174
|
Local ready
Direct docking supported
|
|
E3L044000
BDB044000
|
BDBM50018705
Cc1c(C(=O)NCCN2CCOCC2)sc2c1[nH]c(=O)c1ccccc12
|
C19H21N3O3S 371.462000 |
ZNTLLJAZXHKDQU-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50018705; PubChem:CID86298606
|
Local ready
Direct docking supported
|