| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011301
BDB011301
|
BDBM236351
COc1ccccc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(C1CCOCC1)C2=O
|
C28H31ClN2O3 479.020000 |
OSLNVLCEPCZWRC-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236351; PubChem:CID86703182
|
Local ready
Direct docking supported
|
|
E3L011302
BDB011302
|
BDBM236352
COc1ncc(-c2cc3c(n2C(C)C)C(c2ccc(Cl)cc2C)N(C2CCOCC2)C3=O)c(OC)n1
|
C27H31ClN4O4 511.022000 |
TVCFLHMUHMTBGT-UHFFFAOYSA-N | O15151, Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236352; PubChem:CID90016457
|
Local ready
Direct docking supported
|
|
E3L011303
BDB011303
|
BDBM236353
COc1ncc(-c2cc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(C2CCNCC2)C3=O)c(OC)n1
|
C26H30ClN5O3 496.011000 |
MMDOZNCKVZBKSH-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236353; PubChem:CID86703184
|
Local ready
Direct docking supported
|
|
E3L011304
BDB011304
|
BDBM236354
CNC(=O)N1CCC(N2C(=O)c3cc(-c4cnc(OC)nc4OC)n(C(C)C)c3C2c2ccc(Cl)cc2)CC1
|
C28H33ClN6O4 553.063000 |
FSAYSWYPULVFEH-UHFFFAOYSA-N | O15151, Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236354; PubChem:CID86703187
|
Local ready
Direct docking supported
|
|
E3L011305
BDB011305
|
BDBM236355
COc1nc(N)ncc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(C1CCC(=O)N(C)C1)C2=O
|
C26H29ClN6O3 509.010000 |
BKRCNHSWDZEYIT-UHFFFAOYSA-N | O15151, Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236355; PubChem:CID86703188
|
Local ready
Direct docking supported
|
|
E3L011306
BDB011306
|
BDBM236356
COc1ncc(-c2cc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(C2CCC(=O)N(C)C2)C3=O)c(OC)n1
|
C27H30ClN5O4 524.021000 |
HWKSKTWPKRZFEQ-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236356; PubChem:CID90016360
|
Local ready
Direct docking supported
|
|
E3L011307
BDB011307
|
BDBM236357
COc1ncc(-c2cc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(C2CN(C)C(=O)N(C)C2)C3=O)c(OC)n1
|
C27H31ClN6O4 539.036000 |
JQBLJMJODXODCK-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236357; PubChem:CID86703190
|
Local ready
Direct docking supported
|
|
E3L011308
BDB011308
|
BDBM236358
COc1ncc(-c2cc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cn(C)c(=O)cc2C)C3=O)c(OC)n1
|
C28H28ClN5O4 534.016000 |
VMAKRIBRIRXACI-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236358; PubChem:CID86703192
|
Local ready
Direct docking supported
|
|
E3L011309
BDB011309
|
BDBM236359
COc1nc(N(C)C)ncc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cn(C)c(=O)cc1C)C2=O
|
C29H31ClN6O3 547.059000 |
DZVVZBDVIPZGIS-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236359; PubChem:CID72205349
|
Local ready
Direct docking supported
|
|
E3L011310
BDB011310
|
BDBM236360
COc1cccnc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O
|
C28H25Cl2N3O2 506.433000 |
DYHDRBWGUXTIKZ-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236360; PubChem:CID72205350
|
Local ready
Direct docking supported
|
|
E3L011311
BDB011311
|
BDBM236361
COc1ccc(S(C)(=O)=O)cc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O
|
C30H28Cl2N2O4S 583.537000 |
MTEVACWRYGNEMB-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236361; PubChem:CID72205351
|
Local ready
Direct docking supported
|
|
E3L011312
BDB011312
|
BDBM236362
COc1ccccc1-c1c(F)c2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O
|
C29H25Cl2FN2O2 523.435000 |
MDUZDRLEWCSTAN-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236362; PubChem:CID72205539
|
Local ready
Direct docking supported
|
|
E3L011313
BDB011313
|
BDBM236363
COc1ccccc1-c1cc2c(n1C(C)C)C(C)(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O
|
C30H28Cl2N2O2 519.472000 |
GSQJRMZJYWCMON-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236363; PubChem:CID86703196
|
Local ready
Direct docking supported
|
|
E3L011314
BDB011314
|
BDBM236364
COc1ncc(-c2cc3c(n2C(C)C)C(C)(c2ccc(Cl)cc2)N(c2cc(Cl)c(=O)n(C)c2)C3=O)c(OC)n1
|
C28H27Cl2N5O4 568.461000 |
VNOJIJITXHFGMF-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236364; PubChem:CID90015510
|
Local ready
Direct docking supported
|
|
E3L011315
BDB011315
|
BDBM236365
COc1ccc(CC(=O)O)cc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O
|
C30H27Cl2N3O5 580.468000 |
ZKXXUOFBGYBXBG-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB
BindingDB:BDBM236365
|
Local ready
Direct docking supported
|
|
E3L011316
BDB011316
|
BDBM236366
COc1ccc(S(C)(=O)=O)cc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O
|
C29H27Cl2N3O5S 600.524000 |
YOEKVFPZVBQFQS-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236366; PubChem:CID72205541
|
Local ready
Direct docking supported
|
|
E3L011317
BDB011317
|
BDBM236367
COc1ncc(-c2c(C#N)c3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(Cl)c(=O)n(C)c2)C3=O)c(OC)n1
|
C28H24Cl2N6O4 579.444000 |
OWVWJRURQNSUGV-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236367; PubChem:CID72205542
|
Local ready
Direct docking supported
|
|
E3L011318
BDB011318
|
BDBM236368
COc1ncc(-c2cc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)c(=O)n(C)c2)C3=O)c(OC)n1
|
C27H25Cl2N5O4 554.434000 |
VTGDOFNBBBIIFU-QFIPXVFZSA-N | O15151, Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236368; PubChem:CID72205543
|
Local ready
Direct docking supported
|
|
E3L011319
BDB011319
|
BDBM236369
COc1ncc(-c2cc3c(n2C(C)C)[C@@H](c2ccc(Cl)cc2)N(c2cc(Cl)c(=O)n(C)c2)C3=O)c(OC)n1
|
C27H25Cl2N5O4 554.434000 |
VTGDOFNBBBIIFU-JOCHJYFZSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB, PubChem
BindingDB:BDBM236369; PubChem:CID72205728
|
Local ready
Direct docking supported
|
|
E3L011320
BDB011320
|
BDBM236370
COc1nc(N(C)C)ncc1-c1cc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)c[nH]c1=O)C2=O
|
C27H26Cl2N6O3 553.450000 |
IINPVBUJBKIHAS-UHFFFAOYSA-N | Q00987 | Cellular tumor antigen p53 |
BindingDB
BindingDB:BDBM236370
|
Local ready
Direct docking supported
|