| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L059221
BDB059221
|
BDBM50526803
C=CC(=O)Nc1ccc(C(=O)Nc2cccc(Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)c2)cc1
|
C34H38N8O3 606.731000 |
VBYGXNURPHQSPG-MUUNZHRXSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50526803; PubChem:CID121444083
|
Local ready
Direct docking supported
|
|
E3L059222
BDB059222
|
BDBM50526804
CC(C)c1cnn2c(NCc3ccccc3)cc(NC[C@]3(CO)CCNC3)nc12
|
C22H30N6O 394.523000 |
AUZGEDPWRMYCLE-QFIPXVFZSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50526804; PubChem:CID155555568
|
Local ready
Direct docking supported
|
|
E3L059223
BDB059223
|
BDBM50526805
CC(C)c1cnn2c(NCc3ccccc3)cc(NCC3CCNCC3)nc12
|
C22H30N6 378.524000 |
JKCBZAYPKOXUKH-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50526805; PubChem:CID118329761
|
Local ready
Direct docking supported
|
|
E3L059224
BDB059224
|
BDBM50526807
C=CC(=O)Nc1ccc(C(=O)Nc2ccc(Nc3n[nH]c4c3CN(C(=O)N[C@H](CN(C)C)c3ccccc3)C4(C)C)cc2)cc1
|
C34H38N8O3 606.731000 |
AVLOXJCCPGBYDS-MUUNZHRXSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM50526807; PubChem:CID124134260
|
Local ready
Direct docking supported
|
|
E3L059225
BDB059225
|
H-Asp-DL-Thz-Glu-Thr-Gly-Glu-DL-Cha-OH
C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)C1CSCN1C(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)NC(CC1CCCCC1)C(=O)O
|
C33H51N7O15S 817.872000 |
FUUDVOORWGNXAX-MMHDWFACSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50526864; PubChem:CID155540103
|
Local ready
Direct docking supported
|
|
E3L059226
BDB059226
|
Nidufexor
Cn1nc(C(=O)N(Cc2ccccc2)Cc2ccc(C(=O)O)cc2)c2c1-c1cc(Cl)ccc1OC2
|
C27H22ClN3O4 487.943000 |
JYTIXGYXBIBOMN-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50527021; PubChem:CID118063735
|
Local ready
Direct docking supported
|
|
E3L059227
BDB059227
|
BDBM50527216
O=C(NNS(=O)(=O)c1ccccc1F)c1cccc(OC(F)(F)F)c1
|
C14H10F4N2O4S 378.303000 |
CSRFSYQFYVIKRJ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527216; PubChem:CID135298592
|
Local ready
Direct docking supported
|
|
E3L059228
BDB059228
|
N'-(benzenesulfonyl)-3-propan-2-ylbenzohydrazide
CC(C)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2)c1
|
C16H18N2O3S 318.398000 |
PBPWDVOISWMRMQ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527217; PubChem:CID124132111
|
Local ready
Direct docking supported
|
|
E3L059229
BDB059229
|
BDBM50527218
Cc1cc(OC(C)C)cc(C(=O)NNS(=O)(=O)c2ccccc2)c1F
|
C17H19FN2O4S 366.414000 |
REQXSAOLNCUPGK-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527218; PubChem:CID135298580
|
Local ready
Direct docking supported
|
|
E3L059230
BDB059230
|
BDBM50527219
O=C(NNS(=O)(=O)c1cccc(O)c1F)c1cc(F)cc(-c2ccccc2)c1
|
C19H14F2N2O4S 404.394000 |
IWFLLEGBETVBKZ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527219; PubChem:CID155555713
|
Local ready
Direct docking supported
|
|
E3L059231
BDB059231
|
BDBM50527220
O=C(NNS(=O)(=O)c1ccccc1F)c1cccc(-n2cccn2)c1
|
C16H13FN4O3S 360.370000 |
RTAIDSNRSGJQHT-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527220; PubChem:CID135298595
|
Local ready
Direct docking supported
|
|
E3L059232
BDB059232
|
BDBM50527221
O=C(NNS(=O)(=O)c1ccccc1F)c1cc(F)cc(-n2cccn2)c1
|
C16H12F2N4O3S 378.360000 |
QWXYCBJVEKGULU-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527221; PubChem:CID135298637
|
Local ready
Direct docking supported
|
|
E3L059233
BDB059233
|
BDBM50527222
COc1cc(OC(C)C)cc(C(=O)NNS(=O)(=O)c2ccccc2F)c1
|
C17H19FN2O5S 382.413000 |
YNTZZIQZRUVKNU-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527222; PubChem:CID135298667
|
Local ready
Direct docking supported
|
|
E3L059234
BDB059234
|
BDBM50527223
O=C(NNS(=O)(=O)c1ccccc1)c1cc(-c2ccnnc2)ccc1F
|
C17H13FN4O3S 372.381000 |
WYMCVPPNOFFNGE-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527223; PubChem:CID131750228
|
Local ready
Direct docking supported
|
|
E3L059235
BDB059235
|
BDBM50527224
COc1cc(C(=O)NNS(=O)(=O)c2ccccc2F)cc(-c2ccccn2)c1
|
C19H16FN3O4S 401.419000 |
BPRHUJQGPQDKMZ-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527224; PubChem:CID135298631
|
Local ready
Direct docking supported
|
|
E3L059236
BDB059236
|
BDBM50527225
O=C(NNS(=O)(=O)c1ccccc1F)c1cc(F)cc(-c2ccco2)c1
|
C17H12F2N2O4S 378.356000 |
RWQOQMGTLWPYQB-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527225; PubChem:CID124132203
|
Local ready
Direct docking supported
|
|
E3L059237
BDB059237
|
BDBM50527226
CCOc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccccc2F)c1
|
C16H17FN2O5S 368.386000 |
LMTBKXLCGOPLTE-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527226; PubChem:CID135298611
|
Local ready
Direct docking supported
|
|
E3L059238
BDB059238
|
BDBM50527227
C=CCOc1cccc(C(=O)NNS(=O)(=O)c2ccccc2F)c1
|
C16H15FN2O4S 350.371000 |
IIQYUKXHRIQSTO-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527227; PubChem:CID135298599
|
Local ready
Direct docking supported
|
|
E3L059239
BDB059239
|
N'-[(2-fluorophenyl)sulfonyl]-3-iodobenzohydrazide
O=C(NNS(=O)(=O)c1ccccc1F)c1cccc(I)c1
|
C13H10FIN2O3S 420.203000 |
WRILZXKUOHKYFI-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527228; PubChem:CID135298708
|
Local ready
Direct docking supported
|
|
E3L059240
BDB059240
|
N'-(benzenesulfonyl)-3-pyridin-2-ylbenzohydrazide
O=C(NNS(=O)(=O)c1ccccc1)c1cccc(-c2ccccn2)c1
|
C18H15N3O3S 353.403000 |
JFMOGUHGUYVDEE-UHFFFAOYSA-N | Q92794 | Histone acetyltransferase KAT6A |
BindingDB, PubChem
BindingDB:BDBM50527229; PubChem:CID124132171
|
Local ready
Direct docking supported
|