| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012441
BDB012441
|
BDBM264454
COc1ccc(-n2nc(C)c3c2C(c2ccc(Cl)cc2)N(c2cc(C)c(=O)n(C)c2)C3=O)cn1
|
C25H22ClN5O3 475.936000 |
UZPOOTYPBOTHKT-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264454; PubChem:CID86344278
|
Local ready
Direct docking supported
|
|
E3L012442
BDB012442
|
BDBM264455
COc1ccc(-n2nc(C)c3c2[C@@H](c2ccc(Cl)cc2)N(c2cc(C)c(=O)n(C)c2)C3=O)cn1
|
C25H22ClN5O3 475.936000 |
UZPOOTYPBOTHKT-JOCHJYFZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264455; PubChem:CID135120993
|
Local ready
Direct docking supported
|
|
E3L012443
BDB012443
|
BDBM264456
COc1ncc(NC2=C(C(C)=N)C(=O)N(c3cc(C)c(=O)n(C)c3)C2c2ccc(Cl)cc2)cn1
|
C24H23ClN6O3 478.940000 |
BHZGECKOYMLRSO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB
BindingDB:BDBM264456
|
Local ready
Direct docking supported
|
|
E3L012444
BDB012444
|
BDBM264457
COc1ncc(-n2nc(C)c3c2[C@@H](c2ccc(Cl)cc2)N(c2cc(C)c(=O)n(C)c2)C3=O)cn1
|
C24H21ClN6O3 476.924000 |
BKDMSQCDGPSQFW-HXUWFJFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264457; PubChem:CID135120994
|
Local ready
Direct docking supported
|
|
E3L012445
BDB012445
|
BDBM264458
Cc1cc(N2C(=O)c3c(C4CC4)nn(-c4ccnn4C)c3[C@H]2c2ccc(Cl)cc2)cn(C)c1=O
|
C25H23ClN6O2 474.952000 |
YAUNGVSDDBLIPR-JOCHJYFZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264458; PubChem:CID86344281
|
Local ready
Direct docking supported
|
|
E3L012446
BDB012446
|
BDBM264459
Cc1cc(N2C(=O)c3c(C4CC4)n[nH]c3C2c2ccc(Cl)cc2)cn(C)c1=O
|
C21H19ClN4O2 394.862000 |
SJACAKNFJFXOJF-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264459; PubChem:CID86344282
|
Local ready
Direct docking supported
|
|
E3L012447
BDB012447
|
BDBM264460
Cc1cc(N2C(=O)c3c(C4CC4)n[nH]c3[C@H]2c2ccc(Cl)cc2)cn(C)c1=O
|
C21H19ClN4O2 394.862000 |
SJACAKNFJFXOJF-LJQANCHMSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264460; PubChem:CID86344283
|
Local ready
Direct docking supported
|
|
E3L012448
BDB012448
|
BDBM264462
COc1ncccc1-n1nc2c(c1C)C(=O)N(c1cc(C)c(=O)n(C)c1)[C@@H]2c1ccc(Cl)cc1
|
C25H22ClN5O3 475.936000 |
JFPHLFWFVVJKQO-JOCHJYFZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264462; PubChem:CID86344464
|
Local ready
Direct docking supported
|
|
E3L012449
BDB012449
|
BDBM264463
Cc1[nH]nc2c1C(=O)N(c1cc(C)c(=O)n(C)c1)[C@@H]2c1ccc(Cl)cc1
|
C19H17ClN4O2 368.824000 |
FFHFKSXIZXKTRE-QGZVFWFLSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264463; PubChem:CID86344465
|
Local ready
Direct docking supported
|
|
E3L012450
BDB012450
|
BDBM264464
Cc1[nH]nc2c1C(=O)N(c1cc(Cl)c(=O)n(C)c1)[C@@H]2c1ccc(Cl)cc1
|
C18H14Cl2N4O2 389.242000 |
LRWGLQDVNJOJKQ-MRXNPFEDSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM264464; PubChem:CID86344466
|
Local ready
Direct docking supported
|
|
E3L012451
BDB012451
|
BDBM271345
O=C1Nc2nc3ccccc3n2Cc2cccc(c2)-c2ccc(=O)n(n2)Cc2cccc1c2
|
C26H19N5O2 433.471000 |
VRJUWQHRDAGDDB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271345; PubChem:CID136213934
|
Local ready
Direct docking supported
|
|
E3L012452
BDB012452
|
BDBM271346
O=C1Nc2nc3ccccc3n2CCc2cccc(c2)-c2ccc(=O)n(n2)Cc2cccc1c2
|
C27H21N5O2 447.498000 |
APAAVVUTKQCRRP-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271346; PubChem:CID136213935
|
Local ready
Direct docking supported
|
|
E3L012453
BDB012453
|
BDBM271347
CN(C)C(=O)Cc1ccc2c(c1)nc1n2Cc2cccc(c2)-c2ccc(=O)n(n2)Cc2cccc(c2)C(=O)N1
|
C30H26N6O3 518.577000 |
YALCUOBBKWMZSF-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM271347
|
Local ready
Direct docking supported
|
|
E3L012454
BDB012454
|
BDBM271348
Cc1cc(=O)n2nc1-c1cccc(c1)Cn1c(nc3ccccc31)NC(=O)c1cccc(c1)C2
|
C27H21N5O2 447.498000 |
GCKFVCZQGFRHGF-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271348; PubChem:CID136213937
|
Local ready
Direct docking supported
|
|
E3L012455
BDB012455
|
BDBM271349
CN(C)C(=O)Cc1ccc2nc3n(c2c1)Cc1cccc(c1)-c1ccc(=O)n(n1)Cc1cccc(c1)C(=O)N3
|
C30H26N6O3 518.577000 |
OFWRVYSOKPKAHF-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM271349
|
Local ready
Direct docking supported
|
|
E3L012456
BDB012456
|
BDBM271350
COc1cc2nc3n(c2cc1OC)Cc1cccc(c1)-c1ccc(=O)n(n1)Cc1cccc(c1)C(=O)N3
|
C28H23N5O4 493.523000 |
JGIVBAJRUSCFOB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271350; PubChem:CID136213939
|
Local ready
Direct docking supported
|
|
E3L012457
BDB012457
|
BDBM271351
O=C1Nc2nc3cc(F)c(F)cc3n2Cc2cccc(c2)-c2ccc(=O)n(n2)Cc2cccc1c2
|
C26H17F2N5O2 469.451000 |
HIIJLVAHEFQLOZ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271351; PubChem:CID136213940
|
Local ready
Direct docking supported
|
|
E3L012458
BDB012458
|
BDBM271353
Cc1ccc2cc1-c1ccc(=O)n(n1)Cc1cccc(c1)C(=O)Nc1nc3ccccc3n1C2
|
C27H21N5O2 447.498000 |
OGWSYKLRGBGHNC-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271353; PubChem:CID136213942
|
Local ready
Direct docking supported
|
|
E3L012459
BDB012459
|
BDBM271354
O=C1Nc2nc3ccccc3n2CCOc2cccc(c2)-c2ccc(=O)n(n2)Cc2cccc1c2
|
C27H21N5O3 463.497000 |
FFVRLDPCFDTIJB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271354; PubChem:CID136213943
|
Local ready
Direct docking supported
|
|
E3L012460
BDB012460
|
BDBM271355
O=C1Nc2nc3ccccc3n2Cc2ccc(F)c(c2)-c2ccc(=O)n(n2)Cc2cccc1c2
|
C26H18FN5O2 451.461000 |
IQCUWIFHLQBRRY-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM271355; PubChem:CID136213944
|
Local ready
Direct docking supported
|