| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029741
BDB029741
|
US11649231, Example 1-1K
O=C1NC(=S)S/C1=C\c1cnn(-c2ccccc2)c1
|
C13H9N3OS2 287.369000 |
DZBOJHSPQXHPEC-WDZFZDKYSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602730; PubChem:CID9027736
|
Local ready
Direct docking supported
|
|
E3L029742
BDB029742
|
US11649231, Example 1-8
O=C1NC(=S)S/C1=C\c1cnn(-c2ccc(F)cc2)c1
|
C13H8FN3OS2 305.359000 |
NEPGOCUKNORYKY-WZUFQYTHSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602733; PubChem:CID151182491
|
Local ready
Direct docking supported
|
|
E3L029743
BDB029743
|
US11649231, Example 1-17
O=C1NC(=S)S/C1=C\c1cnn(-c2ccc(Cl)cc2)c1
|
C13H8ClN3OS2 321.814000 |
NRXAIYMSWFXNLC-WZUFQYTHSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602736; PubChem:CID45906681
|
Local ready
Direct docking supported
|
|
E3L029744
BDB029744
|
US11649231, Example 1-35
O=C1NC(=S)S/C1=C\c1cnn(-c2cccnc2)c1
|
C12H8N4OS2 288.357000 |
XITDUDYYAZYCHU-WMZJFQQLSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602740; PubChem:CID152397678
|
Local ready
Direct docking supported
|
|
E3L029745
BDB029745
|
US11649231, Example 1-37
Cc1c(/C=C2\SC(=S)NC2=O)cnn1-c1ccccc1
|
C14H11N3OS2 301.396000 |
JBFBLQCKXXJPAX-GHXNOFRVSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602741; PubChem:CID150647632
|
Local ready
Direct docking supported
|
|
E3L029746
BDB029746
|
US11649231, Example 1-56
O=C1NC(=S)S/C1=C\c1ccn(-c2ccccn2)n1
|
C12H8N4OS2 288.357000 |
YSPVLADFQCURFJ-CLFYSBASSA-N | Q9BVC4 | Target of rapamycin complex subunit LST8 |
BindingDB, PubChem
BindingDB:BDBM602744; PubChem:CID152576692
|
Local ready
Direct docking supported
|
|
E3L029747
BDB029747
|
BDBM606350
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CCOCC3)c2)c1
|
C17H20ClFN4O4S 430.889000 |
IRSRPFQGHMPSMK-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606350; PubChem:CID168474119
|
Local ready
Direct docking supported
|
|
E3L029748
BDB029748
|
BDBM606351
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCCCC3)c2)c1
|
C17H20ClFN4O3S 414.890000 |
POCMKMWYHGVGRH-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606351; PubChem:CID168474120
|
Local ready
Direct docking supported
|
|
E3L029749
BDB029749
|
BDBM606352
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCN(C(=O)OC(C)(C)C)CC3)c2)c1
|
C21H27ClFN5O5S 515.995000 |
LBKNEYFLYRLWOW-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606352; PubChem:CID168474121
|
Local ready
Direct docking supported
|
|
E3L029750
BDB029750
|
BDBM606353
Cn1ccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CCCCC3)c2)n1
|
C18H22ClFN4O3S 428.917000 |
LBFZVHGWILSZPB-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606353; PubChem:CID168474122
|
Local ready
Direct docking supported
|
|
E3L029751
BDB029751
|
BDBM606354
O=C(NNS(=O)(=O)CC1CCCCC1)c1cc(-c2ccccn2)cc(Cl)c1F
|
C19H21ClFN3O3S 425.913000 |
AODVEKWMLQLYHS-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606354; PubChem:CID168474123
|
Local ready
Direct docking supported
|
|
E3L029752
BDB029752
|
BDBM606355
Cn1ccc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CCOCC3)c2)n1
|
C17H20ClFN4O4S 430.889000 |
YYFYUZMZVLEVNV-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606355; PubChem:CID168474124
|
Local ready
Direct docking supported
|
|
E3L029753
BDB029753
|
BDBM606356
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CCCNC3)c2)c1
|
C17H21ClFN5O3S 429.905000 |
XSIOEDFBTUUHCQ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606356; PubChem:CID168474125
|
Local ready
Direct docking supported
|
|
E3L029754
BDB029754
|
BDBM606357
Cn1cc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCOCC3)c2)nc1Cl
|
C16H17Cl2FN4O4S 451.307000 |
OPAGKLGIQKHRMN-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606357; PubChem:CID168474126
|
Local ready
Direct docking supported
|
|
E3L029755
BDB029755
|
BDBM606358
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCOCC3)c2)c1
|
C16H18ClFN4O4S 416.862000 |
VOKRNRFBIZSTNI-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606358; PubChem:CID168474127
|
Local ready
Direct docking supported
|
|
E3L029756
BDB029756
|
BDBM606359
CC(=O)N1CCCC(CS(=O)(=O)NNC(=O)c2cc(-c3cn(C)cn3)cc(Cl)c2F)C1
|
C19H23ClFN5O4S 471.942000 |
JQQMPOZSZSLVDR-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606359; PubChem:CID168474128
|
Local ready
Direct docking supported
|
|
E3L029757
BDB029757
|
BDBM606360
Cn1c(Cl)nc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCOCC3)c2)c1Cl
|
C16H16Cl3FN4O4S 485.752000 |
QZCOGXYXDRRAAQ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606360; PubChem:CID168474129
|
Local ready
Direct docking supported
|
|
E3L029758
BDB029758
|
BDBM606361
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)C3CCC3)c2)c1
|
C15H16ClFN4O3S 386.836000 |
NETCHASBARNTOP-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606361; PubChem:CID168474130
|
Local ready
Direct docking supported
|
|
E3L029759
BDB029759
|
BDBM606362
Cn1cnc(-c2cc(Cl)c(F)c(C(=O)NNS(=O)(=O)CC3CCCN(C(=O)C4CCC4)C3)c2)c1
|
C22H27ClFN5O4S 512.007000 |
DSVQSFJROTUEBB-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606362; PubChem:CID168474131
|
Local ready
Direct docking supported
|
|
E3L029760
BDB029760
|
BDBM606363
CC(C)S(=O)(=O)NNC(=O)c1cc(-c2cn(C)cn2)cc(Cl)c1F
|
C14H16ClFN4O3S 374.825000 |
ACIOMVVHDQQQHM-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM606363; PubChem:CID168474132
|
Local ready
Direct docking supported
|