BDBM50195654 3beta-acetoxy-23,24-bisnor-5-en-22-(4-(2-Boc-amino)butanoic acid) amine::CHEMBL385318

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

InChI Key: InChIKey=RDXMXZJECTUCIY-BCRAHPCJSA-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 = 50195654   

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)	BDBM50195654 (3beta-acetoxy-23,24-bisnor-5-en-22-(4-(2-Boc-amino...) Show SMILES C[C@H](CNCC[C@H](NC(=O)OC(C)(C)C)C(O)=O)[C@H]1CC[C@H]2C3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O |t:24| Show InChI InChI=1S/C33H54N2O6/c1-20(19-34-17-14-28(29(37)38)35-30(39)41-31(3,4)5)25-10-11-26-24-9-8-22-18-23(40-21(2)36)12-15-32(22,6)27(24)13-16-33(25,26)7/h8,20,23-28,34H,9-19H2,1-7H3,(H,35,39)(H,37,38)/t20-,23+,24?,25-,26+,27+,28+,32+,33-/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