BDBM1807 3-(benzylsulfanyl)-4-hydroxy-6-phenyl-5,6-dihydro-2H-pyran-2-one::4-Hydroxy-5,6-dihydropyrone deriv. 1b::5,6-Dihydro-4-hydroxy-6-phenyl-3-[(phenylmethyl)thio]-2H-pyran-2-one

SMILES: O=C1CC(OC(=O)C1SCc1ccccc1)c1ccccc1

InChI Key: InChIKey=DRTDHTBNFZGXPK-UHFFFAOYSA-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 = 1807   

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
HIV-1 Protease (Human immunodeficiency virus type 1)	BDBM1807 (3-(benzylsulfanyl)-4-hydroxy-6-phenyl-5,6-dihydro-...) Show SMILES O=C1CC(OC(=O)C1SCc1ccccc1)c1ccccc1 Show InChI InChI=1S/C18H16O3S/c19-15-11-16(14-9-5-2-6-10-14)21-18(20)17(15)22-12-13-7-3-1-4-8-13/h1-10,16-17H,11-12H2	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.90E+3	n/a	n/a	n/a	n/a	4.7	37
Parke-Davis Pharmaceutical Research					Assay Description For determination of IC50 values, HIV-1 protease was added to assay buffer containing inhibitor and the substrate (H-His-Lys-Ala-Arg-Val-Leu- (p-NO2)...				J Med Chem 40: 3781-92 (1997) Article DOI: 10.1021/jm970615f BindingDB Entry DOI: 10.7270/Q29W0CNF
					More data for this Ligand-Target Pair