BDBM50047307 12-Hydroxy-heptadec-16-ynoic acid::CHEMBL33875

SMILES: O[C@H](CCCCCCCCCCC(O)=O)CCCC#C

InChI Key: InChIKey=HBFCVDJQUPEEIC-INIZCTEOSA-N

Data: 1 KI

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 = 50047307   

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 4A4 (Oryctolagus cuniculus)	BDBM50047307 (12-Hydroxy-heptadec-16-ynoic acid | CHEMBL33875) Show SMILES O[C@H](CCCCCCCCCCC(O)=O)CCCC#C Show InChI InChI=1S/C17H30O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h1,16,18H,3-15H2,(H,19,20)/t16-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inactivation of prostaglandin E1 omega-hydroxylase (Cytochrome P450 4A4) in rabbit lung				J Med Chem 36: 1418-24 (1993) BindingDB Entry DOI: 10.7270/Q2Q52NQW
					More data for this Ligand-Target Pair