| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L031301
BDB031301
|
BDBM627089
O=C(c1cnc2[nH]c(=O)[nH]c2c1)N1CCCc2ccccc21
|
C16H14N4O2 294.314000 |
CKEBXIRYZKROIF-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627089; PubChem:CID137525587
|
Local ready
Direct docking supported
|
|
E3L031302
BDB031302
|
BDBM627092
COC(=O)c1cccc2c1CCCN2C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1
|
C19H18N4O4 366.377000 |
LCCZGYFZOWYDFH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627092; PubChem:CID137525613
|
Local ready
Direct docking supported
|
|
E3L031303
BDB031303
|
BDBM627093
NS(=O)(=O)c1ccc(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
|
C15H14N4O4S 346.368000 |
ZGSSMVNDNPNHKI-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627093; PubChem:CID137525625
|
Local ready
Direct docking supported
|
|
E3L031304
BDB031304
|
BDBM627094
NS(=O)(=O)c1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
|
C14H12N4O4S 332.341000 |
GJBFVJBTUNFURC-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627094; PubChem:CID137526223
|
Local ready
Direct docking supported
|
|
E3L031305
BDB031305
|
BDBM627095
CC(=O)Nc1ccc(NC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
|
C16H15N5O3 325.328000 |
DJZKXEMLMCQOBR-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627095; PubChem:CID48746599
|
Local ready
Direct docking supported
|
|
E3L031306
BDB031306
|
BDBM627096
CNC(=O)c1nc2ccccc2n1-c1ccc2[nH]c(=O)[nH]c2c1
|
C16H13N5O2 307.313000 |
VXIFSLMFRFEVHZ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB
BindingDB:BDBM627096
|
Local ready
Direct docking supported
|
|
E3L031307
BDB031307
|
BDBM627097
O=C(c1nc2ccccc2n1-c1ccc2[nH]c(=O)[nH]c2c1)N1CCCCC1
|
C20H19N5O2 361.405000 |
AMYWMZORCCVYOI-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB
BindingDB:BDBM627097
|
Local ready
Direct docking supported
|
|
E3L031308
BDB031308
|
BDBM627098
O=c1[nH]c2cc(-c3ccccc3OCc3ccccc3)cnc2[nH]1
|
C19H15N3O2 317.348000 |
CJVDOZKRJWPLQH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627098; PubChem:CID137526110
|
Local ready
Direct docking supported
|
|
E3L031309
BDB031309
|
BDBM627099
O=C(Nc1cnc2[nH]c(=O)[nH]c2c1)N1CCc2ccccc21
|
C15H13N5O2 295.302000 |
VAZIQWUTVYJFIA-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627099; PubChem:CID167203007
|
Local ready
Direct docking supported
|
|
E3L031310
BDB031310
|
BDBM627100
CNS(=O)(=O)c1ccc(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
|
C16H16N4O4S 360.395000 |
TUANWQUKWZVAFJ-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627100; PubChem:CID137528136
|
Local ready
Direct docking supported
|
|
E3L031311
BDB031311
|
BDBM627101
COC(=O)c1ccc2c(c1)nc(-c1cc(-c3cncn3C)nc3ccccc13)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C29H21N7O3 515.533000 |
YXSAORNBZQGOTF-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627101; PubChem:CID137532148
|
Local ready
Direct docking supported
|
|
E3L031312
BDB031312
|
BDBM627102
CNC(=O)c1ccc2c(c1)nc(-c1ccnc(OC)c1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C22H18N6O3 414.425000 |
GNULMAKDUMUFJH-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627102; PubChem:CID137526212
|
Local ready
Direct docking supported
|
|
E3L031313
BDB031313
|
BDBM627103
CNC(=O)c1cccc2c1CCCN2C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1
|
C19H19N5O3 365.393000 |
IATKIXZJENFJBA-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627103; PubChem:CID137525591
|
Local ready
Direct docking supported
|
|
E3L031314
BDB031314
|
BDBM627104
O=C1c2ccc(Br)cc2CN1c1ccc2[nH]c(=O)[nH]c2c1
|
C15H10BrN3O2 344.168000 |
UMBBGLSZTWJUDK-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627104; PubChem:CID137525636
|
Local ready
Direct docking supported
|
|
E3L031315
BDB031315
|
BDBM627105
CCOC(=O)c1ccc2c(c1)CN(c1ccc3[nH]c(=O)[nH]c3c1)C2=O
|
C18H15N3O4 337.335000 |
IJJNMJZCWRXVEV-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627105; PubChem:CID137525629
|
Local ready
Direct docking supported
|
|
E3L031316
BDB031316
|
BDBM627106
COC(=O)c1ccc2c(c1)CN(c1ccc3[nH]c(=O)[nH]c3c1)C2=O
|
C17H13N3O4 323.308000 |
UODZXWUMTONHCM-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627106; PubChem:CID137525633
|
Local ready
Direct docking supported
|
|
E3L031317
BDB031317
|
BDBM627107
Cn1cncc1-c1cc(-c2nc3cc(C(N)=O)ccc3n2-c2ccc3[nH]c(=O)[nH]c3c2)c2ccccc2n1
|
C28H20N8O2 500.522000 |
HHHUQDVFJUBBCL-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627107; PubChem:CID137532102
|
Local ready
Direct docking supported
|
|
E3L031318
BDB031318
|
BDBM627108
CNC(=O)c1ccc2c(c1)nc(C1(c3ccccc3)CC1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C25H21N5O2 423.476000 |
AISCLBUNGFKYTI-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627108; PubChem:CID137532086
|
Local ready
Direct docking supported
|
|
E3L031319
BDB031319
|
BDBM627109
CNC(=O)c1ccc2c(c1)nc(C1(c3ccc(OC)cc3)CC1)n2-c1ccc2[nH]c(=O)[nH]c2c1
|
C26H23N5O3 453.502000 |
UFWUPKGEMOPLEO-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627109; PubChem:CID137532146
|
Local ready
Direct docking supported
|
|
E3L031320
BDB031320
|
BDBM627110
O=c1[nH]c2ccc(S(=O)(=O)N3CCc4ccccc43)cc2[nH]1
|
C15H13N3O3S 315.354000 |
HMIHREUESYCKIF-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM627110; PubChem:CID7602544
|
Local ready
Direct docking supported
|