| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L055041
BDB055041
|
8-Hydroxy-5-quinolinecarboxylic acid
O=C(O)c1ccc(O)c2ncccc12
|
C10H7NO3 189.170000 |
JGRPKOGHYBAVMW-UHFFFAOYSA-N | P41229 | Lysine-specific demethylase 5C |
BindingDB, PubChem
BindingDB:BDBM50396018; PubChem:CID459617
|
Local ready
Direct docking supported
|
|
E3L055042
BDB055042
|
BDBM50396019
O=C(O)c1ccnc(-c2cc(C(=O)NCCc3ccccc3)ccn2)c1
|
C20H17N3O3 347.374000 |
DSGOLESVOJUGOK-UHFFFAOYSA-N | P29375, P41229, Q9BY66 | Lysine-specific demethylase 5A, Lysine-specific demethylase 5C, Lysine-specific demethylase 5D |
BindingDB, PubChem
BindingDB:BDBM50396019; PubChem:CID45378188
|
Local ready
Direct docking supported
|
|
E3L055043
BDB055043
|
Chetomin
CN1C(=O)[C@]2(Cc3cn([C@]45C[C@@]67SS[C@@](CO)(C(=O)N6[C@H]4Nc4ccccc45)N(C)C7=O)c4ccccc34)SS[C@@]1(CO)C(=O)N2C
|
C31H30N6O6S4 710.885000 |
ZRZWBWPDBOVIGQ-YWZWRZHGSA-N | Q09472 | Hypoxia-inducible factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50396027; PubChem:CID10417379
|
Local ready
Direct docking supported
|
|
E3L055044
BDB055044
|
Kcn-1
COc1ccc(S(=O)(=O)N(Cc2ccc3c(c2)C=CC(C)(C)O3)c2ccccc2)cc1OC
|
C26H27NO5S 465.571000 |
IPZJNJPAVPZHJM-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300, Hypoxia-inducible factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50396040; PubChem:CID16097752
|
Local ready
Direct docking supported
|
|
E3L055045
BDB055045
|
BDBM50396170
O=C(O)CSc1cc(NS(=O)(=O)c2ccc(C(=O)O)cc2)c2ccccc2c1O
|
C19H15NO7S2 433.463000 |
CIERPRDYPKVDJO-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50396170; PubChem:CID1652812
|
Local ready
Direct docking supported
|
|
E3L055046
BDB055046
|
BDBM50396243
CC(C)NC(=O)[C@H]1CC[C@@H](n2c(NC(=O)c3ccc(F)cc3)nc3ccc(CN4CCC(C(C)(C)O)CC4)cc32)CC1
|
C33H44FN5O3 577.745000 |
WSTUJEXAPHIEIM-FEGDYQJNSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50396243
|
Local ready
Direct docking supported
|
|
E3L055047
BDB055047
|
BDBM50396263
CC(C)NC(=O)[C@H]1CC[C@@H](n2c(NC(=O)c3cc(F)cc(F)c3)nc3ccc(CN4CCC(C(C)(C)O)CC4)cc32)CC1
|
C33H43F2N5O3 595.735000 |
GZYCQQBRSRIFII-JAQLMMITSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM50396263
|
Local ready
Direct docking supported
|
|
E3L055048
BDB055048
|
BDBM50396747
Cc1oc(C(N)=O)cc1COc1ccccc1C(N)=O
|
C14H14N2O4 274.276000 |
LHNKAKMIKQLNCA-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50396747; PubChem:CID823807
|
Local ready
Direct docking supported
|
|
E3L055049
BDB055049
|
PRMTs inhibitor A36
O=C(c1ccc(O)c(NC(=O)c2cccc3ccccc23)c1)c1ccc(O)c(NC(=O)c2cccc3ccccc23)c1
|
C35H24N2O5 552.586000 |
OTADGXGGNIAKDM-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50397030; PubChem:CID3683950
|
Local ready
Direct docking supported
|
|
E3L055050
BDB055050
|
BDBM50397771
CC[C@@H](C(=O)OC(C)(C)C)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1
|
C28H33Cl2NO5 534.480000 |
BTIJKFCQUAULPU-YEPCPMPXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397771; PubChem:CID56591154
|
Local ready
Direct docking supported
|
|
E3L055051
BDB055051
|
BDBM50397772
CC[C@@H](CO)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1
|
C24H27Cl2NO4 464.389000 |
PSVIJRZZFHPPFN-LNGMVNIQSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397772; PubChem:CID58573876
|
Local ready
Direct docking supported
|
|
E3L055052
BDB055052
|
BDBM50397774
CC[C@@H](C(=O)OC(C)(C)C)N1C(=O)[C@@](C)(Cc2nnn[nH]2)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1
|
C28H33Cl2N5O3 558.510000 |
JJARPYJBPOGMTN-YEPCPMPXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397774; PubChem:CID67998380
|
Local ready
Direct docking supported
|
|
E3L055053
BDB055053
|
BDBM50397776
CC[C@@H](C(=O)OC(C)(C)C)N1C(=O)[C@@H](CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1
|
C27H31Cl2NO5 520.453000 |
ZEMLYWMOSZRCQL-UWSZBUKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397776; PubChem:CID56591324
|
Local ready
Direct docking supported
|
|
E3L055054
BDB055054
|
BDBM50397777
CCOC(=O)[C@H](CC)N1C(=O)[C@@H](CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1
|
C25H27Cl2NO5 492.399000 |
JFUTVACYJYKVDU-PIBIMKELSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397777; PubChem:CID56591304
|
Local ready
Direct docking supported
|
|
E3L055055
BDB055055
|
BDBM50397778
O=C(O)C[C@H]1C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N(CC2CC2)C1=O
|
C23H23Cl2NO3 432.347000 |
OMAPWASVHLHIRY-NQSCKRDGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50397778; PubChem:CID56591370
|
Local ready
Direct docking supported
|
|
E3L055056
BDB055056
|
BDBM50397960
NC(=O)c1cccc(NC(=O)/C=C\C(=O)O)c1
|
C11H10N2O4 234.211000 |
GNFSYBNDPOBXLJ-PLNGDYQASA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50397960; PubChem:CID2058875
|
Local ready
Direct docking supported
|
|
E3L055057
BDB055057
|
(2E)-4-[(3-carbamoylphenyl)amino]-4-oxobut-2-enoic acid
NC(=O)c1cccc(NC(=O)/C=C/C(=O)O)c1
|
C11H10N2O4 234.211000 |
GNFSYBNDPOBXLJ-SNAWJCMRSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50397961; PubChem:CID717725
|
Local ready
Direct docking supported
|
|
E3L055058
BDB055058
|
Epicept NP-1
Cc1ccc(NCCCN)c([N+](=O)[O-])c1
|
C10H15N3O2 209.249000 |
FKZUPMCBVURANR-UHFFFAOYSA-N | Q92831 | Histone acetyltransferase KAT2B |
BindingDB, PubChem
BindingDB:BDBM50398244; PubChem:CID5276854
|
Local ready
Direct docking supported
|
|
E3L055059
BDB055059
|
BDBM50398351
CCC1=C[C@@](CC)(C[C@H](/C=C/[C@H](C)O)CC)O/C1=C\C(=O)OC
|
C19H30O4 322.445000 |
YNPVSGZQMXBKIO-CEJKPMKJSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50398351; PubChem:CID66575622
|
Local ready
Direct docking supported
|
|
E3L055060
BDB055060
|
BDBM50398352
CCC(=CCC(C)=O)C[C@]1(CC)C=C(CC)C(=O)O1
|
C16H24O3 264.365000 |
WDYOCQRCAMEENX-MRXNPFEDSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB
BindingDB:BDBM50398352
|
Local ready
Direct docking supported
|