BDBM50083589 3-[4-((S)-2-Amino-3-mercapto-propylamino)-phenoxy]-benzoic acid::CHEMBL113226

SMILES: N[C@H](CS)CNc1ccc(Oc2cccc(c2)C(O)=O)cc1

InChI Key: InChIKey=PISFSCPPQAUWHU-LBPRGKRZSA-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 = 50083589   

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
Protein Farnesyltransferase (PFT) (Bos taurus (bovine))	BDBM50083589 (3-[4-((S)-2-Amino-3-mercapto-propylamino)-phenoxy]...) Show SMILES N[C@H](CS)CNc1ccc(Oc2cccc(c2)C(O)=O)cc1 Show InChI InChI=1S/C16H18N2O3S/c17-12(10-22)9-18-13-4-6-14(7-5-13)21-15-3-1-2-11(8-15)16(19)20/h1-8,12,18,22H,9-10,17H2,(H,19,20)/t12-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of bovine Farnesyltransferase in vitro.				Bioorg Med Chem Lett 9: 3301-6 (2000) BindingDB Entry DOI: 10.7270/Q2Q52NT7
					More data for this Ligand-Target Pair