| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L031261
BDB031261
|
BDBM627048
COC(=O)c1cccc2c1CCN2C(=O)c1ccc2[nH]c(=O)[nH]c2c1
|
C18H15N3O4 337.335000 |
UWQSAHBXLUTOPT-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627048; PubChem:CID137525915
|
Local ready
Direct docking supported
|
|
E3L031262
BDB031262
|
BDBM627049
O=C(c1cnc2[nH]c(=O)[nH]c2c1)N1CCc2ccccc21
|
C15H12N4O2 280.287000 |
AKJSJYQILORRAK-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627049; PubChem:CID137525571
|
Local ready
Direct docking supported
|
|
E3L031263
BDB031263
|
BDBM627050
CC(=O)N1CCC(NC(=O)c2cnc3[nH]c(=O)[nH]c3c2)CC1
|
C14H17N5O3 303.322000 |
AKYNAXLQXGTNLR-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627050; PubChem:CID128436932
|
Local ready
Direct docking supported
|
|
E3L031264
BDB031264
|
BDBM627051
CNC(=O)c1ccc2c(c1)nc(-c1cccc(COC)c1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C24H21N5O3 427.464000 |
OISRSVSHXUTSLQ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627051; PubChem:CID148772756
|
Local ready
Direct docking supported
|
|
E3L031265
BDB031265
|
5-Piperazin-1-yl-1,3-dihydrobenzimidazol-2-one
O=c1[nH]c2ccc(N3CCNCC3)cc2[nH]1
|
C11H14N4O 218.260000 |
DKZJVYOABVOIBO-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627052; PubChem:CID82493552
|
Local ready
Direct docking supported
|
|
E3L031266
BDB031266
|
BDBM627053
O=c1[nH]c2ccc(N3C[C@H]4CC[C@@H](C3)N4)cc2[nH]1
|
C13H16N4O 244.298000 |
CZVGCZWUPOAWQU-DTORHVGOSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627053; PubChem:CID137525609
|
Local ready
Direct docking supported
|
|
E3L031267
BDB031267
|
BDBM627054
CNC(=O)c1cccc2c1nc(C(C)C)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C19H19N5O2 349.394000 |
JICCGRJDMHGNLC-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627054; PubChem:CID137530789
|
Local ready
Direct docking supported
|
|
E3L031268
BDB031268
|
BDBM627055
O=c1[nH]c2ccc(-n3c(CO)nc4ccccc43)cc2[nH]1
|
C15H12N4O2 280.287000 |
COIRMXGKWBJNRN-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB
BindingDB:BDBM627055
|
Local ready
Direct docking supported
|
|
E3L031269
BDB031269
|
BDBM627056
CC(=O)N1CCN(c2ccc3[nH]c(=O)[nH]c3c2)CC1
|
C13H16N4O2 260.297000 |
SKOAJHDLYSDNOU-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627056; PubChem:CID110642420
|
Local ready
Direct docking supported
|
|
E3L031270
BDB031270
|
BDBM627057
CC(=O)N1[C@@H]2CC[C@H]1CN(c1ccc3[nH]c(=O)[nH]c3c1)C2
|
C15H18N4O2 286.335000 |
WCIHXZRGZLDYBE-TXEJJXNPSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627057; PubChem:CID137526062
|
Local ready
Direct docking supported
|
|
E3L031271
BDB031271
|
BDBM627058
CNC(=O)c1ccc2c(c1)nc(C1CCOCC1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C21H21N5O3 391.431000 |
XRVHCRXJHYPXTK-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627058; PubChem:CID137525623
|
Local ready
Direct docking supported
|
|
E3L031272
BDB031272
|
BDBM627059
CNC(=O)c1ccc2c(c1)nc(-c1cn(C)cn1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C20H17N7O2 387.403000 |
LZKFWOBULHUKRW-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627059; PubChem:CID154591721
|
Local ready
Direct docking supported
|
|
E3L031273
BDB031273
|
BDBM627060
CNC(=O)c1ccc2c(c1)nc(-c1cc[nH]c1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C20H16N6O2 372.388000 |
QNIHWTJMBURBCJ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627060; PubChem:CID137526235
|
Local ready
Direct docking supported
|
|
E3L031274
BDB031274
|
BDBM627061
O=C(Nc1ccccc1)c1cnc2[nH]c(=O)[nH]c2c1
|
C13H10N4O2 254.249000 |
DWIRVSOHTSBXJJ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627061; PubChem:CID137526074
|
Local ready
Direct docking supported
|
|
E3L031275
BDB031275
|
BDBM627062
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1coc2ccccc12
|
C16H11N3O3 293.282000 |
KMGZZPVPQJOIEP-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627062; PubChem:CID137525867
|
Local ready
Direct docking supported
|
|
E3L031276
BDB031276
|
BDBM627063
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)C1CCc2ccccc21
|
C17H15N3O2 293.326000 |
QOSJPHCHOXRCIE-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627063; PubChem:CID137526098
|
Local ready
Direct docking supported
|
|
E3L031277
BDB031277
|
BDBM627064
Nc1ccc(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
|
C15H14N4O2 282.303000 |
MHIZROLTSACZMG-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627064; PubChem:CID43620683
|
Local ready
Direct docking supported
|
|
E3L031278
BDB031278
|
BDBM627065
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@H]1CCCc2ccccc21
|
C18H17N3O2 307.353000 |
QBTRVRUNUSZMLW-AWEZNQCLSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627065; PubChem:CID142535931
|
Local ready
Direct docking supported
|
|
E3L031279
BDB031279
|
BDBM627066
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@@H]1CCCc2ccccc21
|
C18H17N3O2 307.353000 |
QBTRVRUNUSZMLW-CQSZACIVSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627066; PubChem:CID137525932
|
Local ready
Direct docking supported
|
|
E3L031280
BDB031280
|
N-(2-Oxo-2,3-dihydro-1H-benzo[d]imidazol-5-yl)benzamide
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1
|
C14H11N3O2 253.261000 |
CAXKIPJNIUSENT-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627067; PubChem:CID4218704
|
Local ready
Direct docking supported
|