BDBM50195648 3beta-ol-23,24-bisnor-5-en-22-(heptanoic acid) amine::CHEMBL424916

SMILES: C[C@H](CNCCCCCCC(O)=O)[C@H]1CC[C@H]2C3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI Key: InChIKey=QWQFPPVMSBGIJB-XJVGCGQLSA-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 = 50195648   

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
24-sterol C-methyltransferase (Arabidopsis thaliana)	BDBM50195648 (3beta-ol-23,24-bisnor-5-en-22-(heptanoic acid) ami...) Show SMILES C[C@H](CNCCCCCCC(O)=O)[C@H]1CC[C@H]2C3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |t:19| Show InChI InChI=1S/C29H49NO3/c1-20(19-30-17-7-5-4-6-8-27(32)33)24-11-12-25-23-10-9-21-18-22(31)13-15-28(21,2)26(23)14-16-29(24,25)3/h9,20,22-26,30-31H,4-8,10-19H2,1-3H3,(H,32,33)/t20-,22+,23?,24-,25+,26+,28+,29-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Cardiff University Curated by ChEMBL					Assay Description Inhibition of Leishmania major recombinant 24-SMT				J Med Chem 49: 6094-103 (2006) Article DOI: 10.1021/jm060290f BindingDB Entry DOI: 10.7270/Q2TB16JJ
					More data for this Ligand-Target Pair