| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L040461
BDB040461
|
BDBM761117
Cc1cc(C(C)(C)C(=O)NCc2cc(Cl)c(C3CCC(=O)NC3=O)c(Cl)c2)ccn1
|
C22H23Cl2N3O3 448.350000 |
VUQZHTQPQAZNCP-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761117; PubChem:CID176846796
|
Local ready
Direct docking supported
|
|
E3L040462
BDB040462
|
BDBM761118
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccc(F)cc1
|
C22H21Cl2FN2O3 451.325000 |
XONZKWSVSCWEDW-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761118; PubChem:CID176846894
|
Local ready
Direct docking supported
|
|
E3L040463
BDB040463
|
BDBM761119
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccnc(C(F)(F)F)c1
|
C22H20Cl2F3N3O3 502.320000 |
OWCOIVSJXIBWHH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761119; PubChem:CID176846881
|
Local ready
Direct docking supported
|
|
E3L040464
BDB040464
|
BDBM761120
COc1cc(C(C)(C)C(=O)NCc2cc(Cl)c(C3CCC(=O)NC3=O)c(Cl)c2)ccn1
|
C22H23Cl2N3O4 464.349000 |
ZSRSIRYRUHWIML-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761120; PubChem:CID176846753
|
Local ready
Direct docking supported
|
|
E3L040465
BDB040465
|
BDBM761121
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1cccnc1
|
C21H21Cl2N3O3 434.323000 |
CKPLXOHBOTXTLE-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761121; PubChem:CID176157297
|
Local ready
Direct docking supported
|
|
E3L040466
BDB040466
|
BDBM761122
CC(C)(C(=O)NCc1ccc(C2CCC(=O)NC2=O)c(Cl)c1)c1ccccc1
|
C22H23ClN2O3 398.890000 |
DDLLFZJWIRVBAH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761122; PubChem:CID176846757
|
Local ready
Direct docking supported
|
|
E3L040467
BDB040467
|
BDBM761123
CC(C)(C(=O)NCc1cc(F)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccncc1
|
C21H21ClFN3O3 417.868000 |
WHKGMVRUYXGHST-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761123; PubChem:CID176157433
|
Local ready
Direct docking supported
|
|
E3L040468
BDB040468
|
BDBM761124
Cc1cc(CNC(=O)C(C)(C)c2ccncc2)cc(Cl)c1C1CCC(=O)NC1=O
|
C22H24ClN3O3 413.905000 |
STCQRJQZKHXXKZ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761124; PubChem:CID176157417
|
Local ready
Direct docking supported
|
|
E3L040469
BDB040469
|
BDBM761125
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccncc1
|
C21H21Cl2N3O3 434.323000 |
HYXAOEOLPMVEDL-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761125; PubChem:CID176846846
|
Local ready
Direct docking supported
|
|
E3L040470
BDB040470
|
BDBM761127
CC(C)(C(=O)NCc1ccc(C2CCC(=O)NC2=O)c(Cl)c1)c1ccncc1
|
C21H22ClN3O3 399.878000 |
CDQPFSQKMORWBU-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761127; PubChem:CID176846930
|
Local ready
Direct docking supported
|
|
E3L040471
BDB040471
|
BDBM761128
Cc1nnc(C(C)(C)C(=O)NCc2cc(Cl)c(C3CCC(=O)NC3=O)c(Cl)c2)o1
|
C19H20Cl2N4O4 439.299000 |
IDNYZHGMALYIBL-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761128; PubChem:CID176157321
|
Local ready
Direct docking supported
|
|
E3L040472
BDB040472
|
BDBM761129
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccno1
|
C19H19Cl2N3O4 424.284000 |
CUNVRCPBAZKDKF-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761129; PubChem:CID176157632
|
Local ready
Direct docking supported
|
|
E3L040473
BDB040473
|
BDBM761130
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccon1
|
C19H19Cl2N3O4 424.284000 |
YLOJZVHCDZOWLL-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761130; PubChem:CID176846823
|
Local ready
Direct docking supported
|
|
E3L040474
BDB040474
|
BDBM761131
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1cnco1
|
C19H19Cl2N3O4 424.284000 |
KHAWHLIUNGIJNU-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761131; PubChem:CID176846849
|
Local ready
Direct docking supported
|
|
E3L040475
BDB040475
|
BDBM761132
Cn1cncc1C(C)(C)C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1
|
C20H22Cl2N4O3 437.327000 |
RUQYPACOXQPIOQ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761132; PubChem:CID176846858
|
Local ready
Direct docking supported
|
|
E3L040476
BDB040476
|
BDBM761133
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ncco1
|
C19H19Cl2N3O4 424.284000 |
IXQLUZGQIWQIND-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761133; PubChem:CID176846786
|
Local ready
Direct docking supported
|
|
E3L040477
BDB040477
|
BDBM761134
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccns1
|
C19H19Cl2N3O3S 440.352000 |
UOQYNUWOIJQPFN-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761134; PubChem:CID176846864
|
Local ready
Direct docking supported
|
|
E3L040478
BDB040478
|
BDBM761135
CC(C)(C(=O)NCc1cc(Cl)c(C2CCC(=O)NC2=O)c(Cl)c1)c1ccsc1
|
C20H20Cl2N2O3S 439.364000 |
IHSRCTGWQQYEMH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761135; PubChem:CID176157305
|
Local ready
Direct docking supported
|
|
E3L040479
BDB040479
|
BDBM761136
O=C1CCC(c2c(Cl)cc(CNC(=O)C3(c4ccccc4)CCOC3)cc2Cl)C(=O)N1
|
C23H22Cl2N2O4 461.345000 |
IUMAAVQQXAHWGI-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761136; PubChem:CID176157586
|
Local ready
Direct docking supported
|
|
E3L040480
BDB040480
|
BDBM761137
O=C1CCC(c2c(Cl)cc(CNC(=O)C3(c4ccccc4)CCOCC3)cc2Cl)C(=O)N1
|
C24H24Cl2N2O4 475.372000 |
RLLXRTCGAQTGMU-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM761137; PubChem:CID176157298
|
Local ready
Direct docking supported
|