| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063321
BDB063321
|
BDBM50616186
COc1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CC(C)(C)C2)cc1
|
C25H28FN5O3 465.529000 |
YVOJLAOIQUZUQF-OXQOHEQNSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616186; PubChem:CID146500378
|
Local ready
Direct docking supported
|
|
E3L063322
BDB063322
|
Ep300/CREBBP-IN-8
COc1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cc1F
|
C25H27F2N5O3 483.519000 |
IQSXIRMYLOUTLS-OXQOHEQNSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616187; PubChem:CID142503978
|
Local ready
Direct docking supported
|
|
E3L063323
BDB063323
|
BDBM50616188
COc1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cn1
|
C24H27FN6O3 466.517000 |
RCEHKCAQWBIRAX-VQIMIIECSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616188; PubChem:CID142504274
|
Local ready
Direct docking supported
|
|
E3L063324
BDB063324
|
Ep300/CREBBP-IN-3
O=C(Nc1ccc2[nH]ncc2n1)[C@H]1C[C@@H](F)CN1C(=O)C1(c2ccc(C(=O)C(F)(F)F)cc2)CCCCC1
|
C26H25F4N5O3 531.510000 |
KBEWWRZSPXHLHF-YLJYHZDGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616189; PubChem:CID142504215
|
Local ready
Direct docking supported
|
|
E3L063325
BDB063325
|
BDBM50616190
O=C(Nc1ccc2[nH]ncc2n1)[C@H]1C[C@@H](F)CN1C(=O)C1(c2ccc(O)cc2)CCCCC1
|
C24H26FN5O3 451.502000 |
PBMHJCCMASLPPP-OXQOHEQNSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616190; PubChem:CID142503983
|
Local ready
Direct docking supported
|
|
E3L063326
BDB063326
|
BDBM50616191
COc1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCC(F)(F)CC2)cc1F
|
C25H25F4N5O3 519.499000 |
NRIAIJGGTLNYII-DNVCBOLYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616191; PubChem:CID172453941
|
Local ready
Direct docking supported
|
|
E3L063327
BDB063327
|
BDBM50616192
COc1c(F)cc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCC(F)(F)CC2)cc1F
|
C25H24F5N5O3 537.489000 |
UFEKXQUEHFRBOH-AUUYWEPGSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616192; PubChem:CID146500463
|
Local ready
Direct docking supported
|
|
E3L063328
BDB063328
|
BDBM50616193
CS(=O)(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCC(F)(F)CC2)cc1
|
C25H26F3N5O4S 549.575000 |
YJLSHHDKIOPEIU-OXQOHEQNSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50616193; PubChem:CID172439185
|
Local ready
Direct docking supported
|
|
E3L063329
BDB063329
|
PARP7 Inhibitor I-1
C[C@@H](CN1CC(C(=O)N2CCN(c3ncc(C(F)(F)F)cn3)CC2)C1)Nc1cn[nH]c(=O)c1C(F)(F)F
|
C21H24F6N8O2 534.465000 |
BMPSOKZAIFFMLK-LBPRGKRZSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50616243; PubChem:CID167312314
|
Local ready
Direct docking supported
|
|
E3L063330
BDB063330
|
BDBM50616253
C[C@@H](CN1CCC(C(=O)N2CCN(c3ncc(C(F)(F)F)cn3)CC2)C1)Nc1cn[nH]c(=O)c1C(F)(F)F
|
C22H26F6N8O2 548.492000 |
USWFYVYRTUSELB-LSLKUGRBSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50616253; PubChem:CID172470580
|
Local ready
Direct docking supported
|
|
E3L063331
BDB063331
|
BDBM50616254
C[C@@H](CN1CCC(C(=O)N2CCN(c3ncc(C(F)(F)F)cn3)CC2)CC1)Nc1cn[nH]c(=O)c1C(F)(F)F
|
C23H28F6N8O2 562.519000 |
RPMYXQXXLPYYLW-AWEZNQCLSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50616254; PubChem:CID169718023
|
Local ready
Direct docking supported
|
|
E3L063332
BDB063332
|
BDBM50616304
CS(=O)(=O)c1cnc(NCc2ccco2)n2cnnc12
|
C11H11N5O3S 293.308000 |
DLBXUYNEPKDZAE-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616304; PubChem:CID172457678
|
Local ready
Direct docking supported
|
|
E3L063333
BDB063333
|
BDBM50616305
c1coc(CNc2ncc(-c3ccc4[nH]ccc4c3)c3nccn23)c1
|
C19H15N5O 329.363000 |
VSGIQGNBLAEVSJ-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616305; PubChem:CID172449180
|
Local ready
Direct docking supported
|
|
E3L063334
BDB063334
|
BDBM50616306
c1coc(CNc2ncc(-c3ccc4[nH]ccc4c3)c3nncn23)c1
|
C18H14N6O 330.351000 |
ZLAKFPUQIUWMCA-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616306; PubChem:CID172454054
|
Local ready
Direct docking supported
|
|
E3L063335
BDB063335
|
BDBM50616307
Cn1ccc2cc(-c3cnc(NCc4ccco4)n4cnnc34)ccc21
|
C19H16N6O 344.378000 |
NQWNPULCFPIMDR-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616307; PubChem:CID172446747
|
Local ready
Direct docking supported
|
|
E3L063336
BDB063336
|
BDBM50616308
CCn1ccc2cc(-c3cnc(NCc4ccco4)n4cnnc34)ccc21
|
C20H18N6O 358.405000 |
VRRYKMOMCYYHJN-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616308; PubChem:CID172445059
|
Local ready
Direct docking supported
|
|
E3L063337
BDB063337
|
BDBM50616309
CC(C)n1ccc2cc(-c3cnc(NCc4ccco4)n4cnnc34)ccc21
|
C21H20N6O 372.432000 |
SXEBICJSYKMRQM-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616309; PubChem:CID172465199
|
Local ready
Direct docking supported
|
|
E3L063338
BDB063338
|
BDBM50616310
c1coc(CNc2ncc(-c3ccc4c(ccn4C4CC4)c3)c3nncn23)c1
|
C21H18N6O 370.416000 |
HVNAINRBUVSUAC-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616310; PubChem:CID172468515
|
Local ready
Direct docking supported
|
|
E3L063339
BDB063339
|
BDBM50616311
Cc1ccc(S(=O)(=O)n2ccc3cc(-c4cnc(NCc5ccco5)n5cnnc45)ccc32)cc1
|
C25H20N6O3S 484.541000 |
SJBAZHQMFWEDSP-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616311; PubChem:CID172442629
|
Local ready
Direct docking supported
|
|
E3L063340
BDB063340
|
BDBM50616312
c1ccc(Cn2ccc3cc(-c4cnc(NCc5ccco5)n5cnnc45)ccc32)cc1
|
C25H20N6O 420.476000 |
NQTAXGRFXMJPGW-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50616312; PubChem:CID172444153
|
Local ready
Direct docking supported
|