BDBM50128557 (3S,10R,13S)-17-Hydrazono-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,10,11,12,13,14,15,17-tetradecahydro-cyclopenta[a]phenanthren-16-one oxime::CHEMBL78063

SMILES: C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CC(NO)=C2N=N

InChI Key: InChIKey=SVRDMFLGNCDZET-LWTNLRHXSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50128557   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cytochrome P450 17A1 (Homo sapiens (Human))	BDBM50128557 ((3S,10R,13S)-17-Hydrazono-3-hydroxy-10,13-dimethyl...) Show SMILES C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CC(NO)=C2N=N |c:23,t:7| Show InChI InChI=1S/C19H29N3O2/c1-18-7-5-12(23)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(22-24)17(19)21-20/h3,12-15,20,22-24H,4-10H2,1-2H3/t12-,13?,14?,15?,18-,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Accelrys Curated by ChEMBL					Assay Description In vitro cytochrome P450 17A1 inhibition was assayed using the rapid acetic acid releasing assay (AARA), utilizing intact P450c17-expressing Escheric...				J Med Chem 46: 2345-51 (2003) Article DOI: 10.1021/jm020576u BindingDB Entry DOI: 10.7270/Q2WD41B7
					More data for this Ligand-Target Pair