Reaction Details Report a problem with these data
Target
17-beta-hydroxysteroid dehydrogenase type 3
Ligand
BDBM50177409
Substrate
n/a
Meas. Tech.
ChEMBL_391451 (CHEMBL870480)
IC50
1708920±n/a nM
Citation
 Lota, RK; Dhanani, S; Owen, CP; Ahmed, S Synthesis, biochemical evaluation and rationalisation of the inhibitory activity of a series of 4-hydroxyphenyl ketones as potential inhibitors of 17beta-hydroxysteroid dehydrogenase type 3 (17beta-HSD3). Bioorg Med Chem Lett 16:4519-22 (2006) [PubMed]  Article 
Target
Name:
17-beta-hydroxysteroid dehydrogenase type 3
Synonyms:
17-beta-hydroxysteroid dehydrogenase type 3 | DHB3_HUMAN | EDH17B3 | Estradiol 17-beta-dehydrogenase 3 | HSD17B3 | SDR12C2
Type:
Enzyme
Mol. Mass.:
34525.39
Organism:
Homo sapiens (Human)
Description:
P37058
Residue:
310
Sequence:
MGDVLEQFFILTGLLVCLACLAKCVRFSRCVLLNYWKVLPKSFLRSMGQWAVITGAGDGIGKAYSFELAKRGLNVVLISRTLEKLEAIATEIERTTGRSVKIIQADFTKDDIYEHIKEKLAGLEIGILVNNVGMLPNLLPSHFLNAPDEIQSLIHCNITSVVKMTQLILKHMESRQKGLILNISSGIALFPWPLYSMYSASKAFVCAFSKALQEEYKAKEVIIQVLTPYAVSTAMTKYLNTNVITKTADEFVKESLNYVTIGGETCGCLAHEILAGFLSLIPAWAFYSGAFQRLLLTHYVAYLKLNTKVR
  
Inhibitor
Name:
BDBM50177409
Synonyms:
(4-hydroxyphenyl)ethan-1-one | 1-(4-hydroxyphenyl)ethanone | 4'-hydroxyacetophenone | 4-Acetylphenol | 4-Hydroxyacetophenone | CHEMBL201083 | Methyl p-hydroxyphenyl ketone | p-Hydroxyacetophenone | p-Hydroxyphenyl methyl ketone | para-Hydroxyacetophenone
Type:
Small organic molecule
Emp. Form.:
C8H8O2
Mol. Mass.:
136.1479
SMILES:
CC(=O)c1ccc(O)cc1
Structure:
Search PDB for entries with ligand similarity: