| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L016881
BDB016881
|
US9890166, Example 112
COc1ncccc1-c1nc2c(n1C(C)C)[C@@H](c1ccc(Cl)cc1)N(c1cc(C)c3nnn(C)c3c1)C2=O
|
C28H26ClN7O2 528.016000 |
GAVLMQAIIHDXBG-XMMPIXPASA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380725; PubChem:CID117723227
|
Local ready
Direct docking supported
|
|
E3L016882
BDB016882
|
BDBM380726
COc1ccc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(OC)c4nnn(C)c4c2)C3=O)cn1
|
C28H26ClN7O3 544.015000 |
JUNKHWUBWMACDY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380726; PubChem:CID117723264
|
Local ready
Direct docking supported
|
|
E3L016883
BDB016883
|
US9890166, Example 114
COc1ccc(-c2nc3c(n2C(C)C)[C@@H](c2ccc(Cl)cc2)N(c2cc(OC)c4nnn(C)c4c2)C3=O)cn1
|
C28H26ClN7O3 544.015000 |
JUNKHWUBWMACDY-RUZDIDTESA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380727; PubChem:CID117723228
|
Local ready
Direct docking supported
|
|
E3L016884
BDB016884
|
BDBM380729
Cc1cc(N2C(=O)c3nc(C4=CCOCC4)[nH]c3C2c2ccc(Cl)cc2)cn2c(C)nnc12
|
C24H21ClN6O2 460.925000 |
WPRFMKAORZZEIZ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380729; PubChem:CID117723310
|
Local ready
Direct docking supported
|
|
E3L016885
BDB016885
|
BDBM380730
COc1ccc(-c2nc3c([nH]2)C(c2ccc(Cl)cc2)N(c2cc(C)c4nnc(C)n4c2)C3=O)cn1
|
C25H20ClN7O2 485.935000 |
CLMSQBWNXNAWOK-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380730; PubChem:CID117723287
|
Local ready
Direct docking supported
|
|
E3L016886
BDB016886
|
US9890166, Example 118
Cc1cc(N2C(=O)c3c(nc(C)n3C(C)C)[C@H]2c2ccc(Cl)cc2)cc2c1nnn2C
|
C23H23ClN6O 434.931000 |
GQVNARRVGGOXNP-OAQYLSRUSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380731; PubChem:CID117720555
|
Local ready
Direct docking supported
|
|
E3L016887
BDB016887
|
US9890166, Example 120
CCn1c(C)nc2c1[C@@H](c1ccc(Cl)cc1)N(c1cc(C)c3nnn(C)c3c1)C2=O
|
C22H21ClN6O 420.904000 |
ZFJHDWKVFUWKQS-HXUWFJFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380732; PubChem:CID117723312
|
Local ready
Direct docking supported
|
|
E3L016888
BDB016888
|
BDBM380733
CCn1c(C)nc2c1C(=O)N(c1cc(C)c3nnn(C)c3c1)C2c1ccc(Cl)cc1
|
C22H21ClN6O 420.904000 |
UCTNVNGRNJPSOM-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380733; PubChem:CID117720823
|
Local ready
Direct docking supported
|
|
E3L016889
BDB016889
|
US9890166, Example 122
CCn1c(C)nc2c1C(=O)N(c1cc(C)c3nnn(C)c3c1)[C@@H]2c1ccc(Cl)cc1
|
C22H21ClN6O 420.904000 |
UCTNVNGRNJPSOM-HXUWFJFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380734; PubChem:CID117720822
|
Local ready
Direct docking supported
|
|
E3L016890
BDB016890
|
BDBM380735
COc1ncccc1-c1nc2c([nH]1)C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C25H20ClN7O2 485.935000 |
QIJUHAIEZZEKSX-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380735; PubChem:CID117723272
|
Local ready
Direct docking supported
|
|
E3L016891
BDB016891
|
BDBM380736
COc1ncc(-c2nc3c([nH]2)C(c2ccc(Cl)cc2)N(c2cc(C)c4nnc(C)n4c2)C3=O)c(OC)n1
|
C25H21ClN8O3 516.949000 |
JHVSPUDTTXELLE-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380736; PubChem:CID117723280
|
Local ready
Direct docking supported
|
|
E3L016892
BDB016892
|
BDBM380737
COc1ccc(-c2nc3c([nH]2)C(c2ccc(Cl)cc2)N(c2cc(OC)c4nnc(C)n4c2)C3=O)cn1
|
C25H20ClN7O3 501.934000 |
SBDOCCVDBJLSLR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380737; PubChem:CID117723231
|
Local ready
Direct docking supported
|
|
E3L016893
BDB016893
|
US9890166, Example 126
COc1ccc(-c2nc3c([nH]2)[C@@H](c2ccc(Cl)cc2)N(c2cc(OC)c4nnc(C)n4c2)C3=O)cn1
|
C25H20ClN7O3 501.934000 |
SBDOCCVDBJLSLR-JOCHJYFZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380738; PubChem:CID117723297
|
Local ready
Direct docking supported
|
|
E3L016894
BDB016894
|
BDBM380739
COc1ncc(-c2nc3c([nH]2)C(c2ccc(Cl)cc2)N(c2cc(OC)c4nnc(C)n4c2)C3=O)c(OC)n1
|
C25H21ClN8O4 532.948000 |
NVUCJVXTEMYIJR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380739; PubChem:CID117723313
|
Local ready
Direct docking supported
|
|
E3L016895
BDB016895
|
US9890166, Example 128
COc1ncc(-c2nc3c([nH]2)[C@@H](c2ccc(Cl)cc2)N(c2cc(OC)c4nnc(C)n4c2)C3=O)c(OC)n1
|
C25H21ClN8O4 532.948000 |
NVUCJVXTEMYIJR-HXUWFJFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380740; PubChem:CID117723289
|
Local ready
Direct docking supported
|
|
E3L016896
BDB016896
|
US9890166, Example 129
COc1ccc(-c2nc3c([nH]2)[C@@H](c2ccc(Cl)cc2)N(c2cc(C)c4nnc(C)n4c2)C3=O)cn1
|
C25H20ClN7O2 485.935000 |
CLMSQBWNXNAWOK-JOCHJYFZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380741; PubChem:CID117723265
|
Local ready
Direct docking supported
|
|
E3L016897
BDB016897
|
BDBM380742
Cc1cc(N2C(=O)c3nc(N4CCOCC4)n(C)c3C2c2ccc(Cl)cc2)cn(C)c1=O
|
C23H24ClN5O3 453.930000 |
XKUUHELVHBNAMN-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380742; PubChem:CID117723314
|
Local ready
Direct docking supported
|
|
E3L016898
BDB016898
|
BDBM380743
Cc1cc(N2C(=O)c3nc(C)n(C(C)C)c3C2c2ccc(Cl)cc2)cn2c(C(F)F)nnc12
|
C23H21ClF2N6O 470.911000 |
BSZDTJJAUVZTBS-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380743; PubChem:CID117723315
|
Local ready
Direct docking supported
|
|
E3L016899
BDB016899
|
BDBM380744
COc1ncccc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C(F)F)n3c1)C2=O
|
C28H24ClF2N7O2 563.996000 |
YORKSQKTPMJQBD-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB
BindingDB:BDBM380744
|
Local ready
Direct docking supported
|
|
E3L016900
BDB016900
|
BDBM380745
COc1ncccc1-c1nc2c([nH]1)C(c1ccc(Cl)cc1)N(c1cc(C)c3nnn(C)c3c1)C2=O
|
C25H20ClN7O2 485.935000 |
RYGFKPUPLGKCHY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM380745; PubChem:CID117723281
|
Local ready
Direct docking supported
|