| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L061561
BDB061561
|
BDBM50584151
COc1ccc(Nc2nc(SCc3ccccc3)nc(-c3cc(OC)c(OC)c(OC)c3)c2C#N)cc1
|
C28H26N4O4S 514.607000 |
OBQUHQMHDKVEEW-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584151; PubChem:CID166626083
|
Local ready
Direct docking supported
|
|
E3L061562
BDB061562
|
BDBM50584152
COc1cc(-c2nc(SCc3ccccc3)nc(NC(C)(C)N3CCOCC3)c2C#N)cc(OC)c1OC
|
C28H33N5O4S 535.670000 |
CPMCCGVHGWGXNB-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584152; PubChem:CID166633381
|
Local ready
Direct docking supported
|
|
E3L061563
BDB061563
|
BDBM50584153
COc1cc(-c2nc(SCc3ccccc3)nc(Nc3ccc(O)c(Cl)c3)c2C#N)cc(OC)c1OC
|
C27H23ClN4O4S 535.025000 |
ITOUXEYPWAVRBM-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584153; PubChem:CID166632655
|
Local ready
Direct docking supported
|
|
E3L061564
BDB061564
|
BDBM50584154
COc1cc(-c2nc(SCc3ccccc3)nc(Nc3cccc(Cl)c3)c2C#N)cc(OC)c1OC
|
C27H23ClN4O3S 519.026000 |
ZUEVJFDYYRBRST-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584154; PubChem:CID145950859
|
Local ready
Direct docking supported
|
|
E3L061565
BDB061565
|
BDBM50584155
COc1cc(-c2nc(SCc3cccc(C(F)(F)F)c3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C25H19F3N4O3S3 576.647000 |
MHQACLBBRGIGEI-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584155; PubChem:CID166634422
|
Local ready
Direct docking supported
|
|
E3L061566
BDB061566
|
BDBM50584156
COc1cc(-c2nc(SCc3ccc(C(F)(F)F)cc3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C25H19F3N4O3S3 576.647000 |
CQCIEYAZOQCXRX-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584156; PubChem:CID166625997
|
Local ready
Direct docking supported
|
|
E3L061567
BDB061567
|
BDBM50584157
COc1cc(-c2nc(SCc3cccc(C)c3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C25H22N4O3S3 522.677000 |
YXGRYKGFUIPGKJ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584157; PubChem:CID166634416
|
Local ready
Direct docking supported
|
|
E3L061568
BDB061568
|
BDBM50584158
COc1cc(-c2nc(SCc3ccc(C)cc3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C25H22N4O3S3 522.677000 |
FXLXWCNABWFGGC-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584158; PubChem:CID166630001
|
Local ready
Direct docking supported
|
|
E3L061569
BDB061569
|
BDBM50584159
COc1cc(-c2nc(SCc3ccccc3C)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C25H22N4O3S3 522.677000 |
YQFSGTZNXVWBJU-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584159; PubChem:CID166635203
|
Local ready
Direct docking supported
|
|
E3L061570
BDB061570
|
BDBM50584160
COc1cc(-c2nc(SCc3ccc(C(C)(C)C)cc3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C28H28N4O3S3 564.758000 |
XHTKZZSSLHRZSP-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584160; PubChem:CID166628238
|
Local ready
Direct docking supported
|
|
E3L061571
BDB061571
|
BDBM50584161
COc1cc(-c2nc(SCc3ccc(Cl)cc3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C24H19ClN4O3S3 543.095000 |
SZEHSMPLAYHMCP-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584161; PubChem:CID166629971
|
Local ready
Direct docking supported
|
|
E3L061572
BDB061572
|
BDBM50584162
COc1ccc(CSc2nc(Sc3nccs3)c(C#N)c(-c3cc(OC)c(OC)c(OC)c3)n2)cc1
|
C25H22N4O4S3 538.676000 |
ITEYFSBDYFNGHN-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584162; PubChem:CID166634574
|
Local ready
Direct docking supported
|
|
E3L061573
BDB061573
|
BDBM50584163
COC(=O)c1ccc(CSc2nc(Sc3nccs3)c(C#N)c(-c3cc(OC)c(OC)c(OC)c3)n2)cc1
|
C26H22N4O5S3 566.686000 |
GGEWGDSOPKRVBG-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584163; PubChem:CID166625262
|
Local ready
Direct docking supported
|
|
E3L061574
BDB061574
|
BDBM50584164
COc1cc(-c2nc(SCc3ccc4ccccc4c3)nc(Sc3nccs3)c2C#N)cc(OC)c1OC
|
C28H22N4O3S3 558.710000 |
WRVUIRASAIRJIM-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584164; PubChem:CID166634062
|
Local ready
Direct docking supported
|
|
E3L061575
BDB061575
|
BDBM50584165
COc1cc(-c2nc(SCc3cccc(C(F)(F)F)c3)nc(Sc3nnnn3C)c2C#N)cc(OC)c1OC
|
C24H20F3N7O3S2 575.598000 |
WCSQSPGROIHZGA-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584165; PubChem:CID166636334
|
Local ready
Direct docking supported
|
|
E3L061576
BDB061576
|
BDBM50584166
COc1cc(-c2nc(SCc3ccc(C(F)(F)F)cc3)nc(Sc3nnnn3C)c2C#N)cc(OC)c1OC
|
C24H20F3N7O3S2 575.598000 |
CEMAPPGDKORLJQ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584166; PubChem:CID166634535
|
Local ready
Direct docking supported
|
|
E3L061577
BDB061577
|
BDBM50584167
COc1cc(-c2nc(SCc3ccc(Cl)cc3)nc(Sc3nnnn3C)c2C#N)cc(OC)c1OC
|
C23H20ClN7O3S2 542.046000 |
ZKZPHQPTGZBOHB-UHFFFAOYSA-N | Q6PH85, Q8IWE4, Q96GG9, Q9BTE7 | DCN1-like protein 1, DCN1-like protein 2, DCN1-like protein 3, DCN1-like protein 5 |
BindingDB, PubChem
BindingDB:BDBM50584167; PubChem:CID163196277
|
Local ready
Direct docking supported
|
|
E3L061578
BDB061578
|
BDBM50584168
COc1ccc(CSc2nc(Sc3nnnn3C)c(C#N)c(-c3cc(OC)c(OC)c(OC)c3)n2)cc1
|
C24H23N7O4S2 537.627000 |
OAODDEWCCAQYKJ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584168; PubChem:CID166626271
|
Local ready
Direct docking supported
|
|
E3L061579
BDB061579
|
BDBM50584169
COc1cc(-c2nc(SCc3ccc4ccccc4c3)nc(Sc3nnnn3C)c2C#N)cc(OC)c1OC
|
C27H23N7O3S2 557.661000 |
WSTFZJXDCONLEI-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584169; PubChem:CID166635137
|
Local ready
Direct docking supported
|
|
E3L061580
BDB061580
|
BDBM50584170
COc1cc(-c2nc(SCc3cccc(C)c3)nc(Sc3nnnn3C)c2C#N)cc(OC)c1OC
|
C24H23N7O3S2 521.628000 |
DHPMOZSRLIZVTN-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM50584170; PubChem:CID166629819
|
Local ready
Direct docking supported
|