BDBM50195623 3beta-acetoxy-23,24-bisnor-5-en-22-(5-(2-Z-amino)pentanoic acid) amide::CHEMBL384335

SMILES: C[C@@H]([C@H]1CC[C@H]2C3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)C(=O)NCCC[C@H](NC(=O)OCc1ccccc1)C(O)=O

InChI Key: InChIKey=HJFJAHHDRLZKFV-YEKXXQHUSA-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 = 50195623   

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)	BDBM50195623 (3beta-acetoxy-23,24-bisnor-5-en-22-(5-(2-Z-amino)p...) Show SMILES C[C@@H]([C@H]1CC[C@H]2C3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)C(=O)NCCC[C@H](NC(=O)OCc1ccccc1)C(O)=O |t:8| Show InChI InChI=1S/C37H52N2O7/c1-23(33(41)38-20-8-11-32(34(42)43)39-35(44)45-22-25-9-6-5-7-10-25)29-14-15-30-28-13-12-26-21-27(46-24(2)40)16-18-36(26,3)31(28)17-19-37(29,30)4/h5-7,9-10,12,23,27-32H,8,11,13-22H2,1-4H3,(H,38,41)(H,39,44)(H,42,43)/t23-,27-,28?,29+,30-,31-,32-,36-,37+/m0/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