| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L030221
BDB030221
|
BDBM606838
Cc1cccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C(C)C3CCCN(C(=O)OC(C)(C)C)C3)c2)c1
|
C26H33ClFN3O5S 554.084000 |
UTBPZCHZNKNUII-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606838; PubChem:CID167076747
|
Local ready
Direct docking supported
|
|
E3L030222
BDB030222
|
BDBM606839
Cc1cccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CN(C)CCN3)c2)c1
|
C20H24ClFN4O3S 454.955000 |
SQTIPABERDHCSI-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606839; PubChem:CID167076714
|
Local ready
Direct docking supported
|
|
E3L030223
BDB030223
|
BDBM606840
Cc1cccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C(C)C3CCCNC3)c2)c1
|
C21H25ClFN3O3S 453.967000 |
VHEXMHNZSFZXNJ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606840; PubChem:CID167076715
|
Local ready
Direct docking supported
|
|
E3L030224
BDB030224
|
BDBM606841
CNCCCS(=O)(=O)NNC(=O)c1cc(-c2cccc(C)c2)ccc1F
|
C18H22FN3O3S 379.457000 |
TVYUNFZNOPLGJN-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606841; PubChem:CID167076281
|
Local ready
Direct docking supported
|
|
E3L030225
BDB030225
|
BDBM606842
CNCCCS(=O)(=O)NNC(=O)c1cc(-c2cccc(C)c2)cc(Cl)c1F
|
C18H21ClFN3O3S 413.902000 |
SLGBIJUYSVHRDU-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606842; PubChem:CID167076283
|
Local ready
Direct docking supported
|
|
E3L030226
BDB030226
|
BDBM606843
Cc1cc(-c2cccc(F)c2)cc(C(=O)NNS(=O)(=O)c2cccc(O)c2)c1F
|
C20H16F2N2O4S 418.421000 |
WRQSYOCTVZDAFB-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606843; PubChem:CID167076284
|
Local ready
Direct docking supported
|
|
E3L030227
BDB030227
|
BDBM606844
O=C(NNS(=O)(=O)c1cccc(O)c1)c1cc(-c2ccccc2)cc(F)c1F
|
C19H14F2N2O4S 404.394000 |
PWYNWVYLCYJEAI-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606844; PubChem:CID167076558
|
Local ready
Direct docking supported
|
|
E3L030228
BDB030228
|
BDBM606845
COCc1cc(Cl)c(F)c(C(=O)NNS(=O)(=O)c2cccc(O)c2)c1
|
C15H14ClFN2O5S 388.804000 |
TXMDSCMIUMKSFO-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606845; PubChem:CID167076632
|
Local ready
Direct docking supported
|
|
E3L030229
BDB030229
|
BDBM606846
O=C(NNS(=O)(=O)c1cccc(O)c1)c1cc(-c2ccccc2)cc(Cl)c1F
|
C19H14ClFN2O4S 420.849000 |
OXCDCJIMYQFIEV-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606846; PubChem:CID167076713
|
Local ready
Direct docking supported
|
|
E3L030230
BDB030230
|
BDBM606847
Cc1cccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CNCCN3C)c2)c1
|
C20H24ClFN4O3S 454.955000 |
XYLFDTVOOKEYBC-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606847; PubChem:CID167076557
|
Local ready
Direct docking supported
|
|
E3L030231
BDB030231
|
BDBM606848
O=C(NNS(=O)(=O)CC1CCCNC1)c1cc(-c2ccccc2)cc(Cl)c1F
|
C19H21ClFN3O3S 425.913000 |
BJSFYBAMMXCJQP-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606848; PubChem:CID134581053
|
Local ready
Direct docking supported
|
|
E3L030232
BDB030232
|
BDBM606849
Cc1cc(-c2ccccc2)cc(C(=O)NNS(=O)(=O)CC2CCCN(C(=O)OC(C)(C)C)C2)c1F
|
C25H32FN3O5S 505.612000 |
CZOIPQLIMUPOHR-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606849; PubChem:CID134581174
|
Local ready
Direct docking supported
|
|
E3L030233
BDB030233
|
BDBM606851
Cc1cc(-c2ccccc2)cc(C(=O)NNS(=O)(=O)CC2CCCNC2)c1F
|
C20H24FN3O3S 405.495000 |
BVAGGKPGWMYBDY-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606851; PubChem:CID134581179
|
Local ready
Direct docking supported
|
|
E3L030234
BDB030234
|
BDBM608065
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1
|
C17H24N4O2 316.405000 |
LZNLPALXNYCFIQ-JYAVWHMHSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM608065
|
Local ready
Direct docking supported
|
|
E3L030235
BDB030235
|
US11691968, Example 9
CC(n1cnc(C(=O)N2CC3C(C2)C3C2=NOC(C)(C)C2)c1)C(F)(F)F
|
C17H21F3N4O2 370.375000 |
TUZBNSGQDAGILF-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM608066; PubChem:CID167524595
|
Local ready
Direct docking supported
|
|
E3L030236
BDB030236
|
BDBM608067
CC[C@H](C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1
|
C18H26N4O2 330.432000 |
PEFVASHQMQLWDE-BCUIYNNISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM608067
|
Local ready
Direct docking supported
|
|
E3L030237
BDB030237
|
US11691968, Example 22
C[C@@H](c1ccccc1C#N)n1cnc(C(=O)N2CC3C(C2)C3C2=NOC(C)(C)C2)c1
|
C23H25N5O2 403.486000 |
ZWKRPZNMZJSQNE-YERMDROSSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM608068; PubChem:CID168474693
|
Local ready
Direct docking supported
|
|
E3L030238
BDB030238
|
US11691968, Example 24
C[C@@H](c1ccc(C#N)cc1)n1cnc(C(=O)N2CC3C(C2)C3C2=NOC(C)(C)C2)c1
|
C23H25N5O2 403.486000 |
UOFGVWKZSHBPSS-YERMDROSSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM608069; PubChem:CID168474694
|
Local ready
Direct docking supported
|
|
E3L030239
BDB030239
|
US11691968, Example 27
C[C@@H](c1nccs1)n1cnc(C(=O)N2CC3C(C2)C3C2=NOC(C)(C)C2)c1
|
C19H23N5O2S 385.493000 |
ZZGPMRWAHXMYPY-KWDKGFIESA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM608070; PubChem:CID167524528
|
Local ready
Direct docking supported
|
|
E3L030240
BDB030240
|
BDBM608071
CC1(C)CC([C@H]2[C@@H]3CN(C(=O)c4cn(C5(C)CC5)cn4)C[C@@H]32)=NO1
|
C18H24N4O2 328.416000 |
WMJCYAIGKJYBIT-JYAVWHMHSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM608071
|
Local ready
Direct docking supported
|