BDBM50054619 4-Hydroxy-6-phenethyl-3-(1-phenyl-propyl)-6-propyl-5,6-dihydro-pyran-2-one::CHEMBL143235

SMILES: CCCC1(CCc2ccccc2)CC(=O)C(C(CC)c2ccccc2)C(=O)O1

InChI Key: InChIKey=BCOGHHBKCRWUPQ-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 50054619   

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
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50054619 (4-Hydroxy-6-phenethyl-3-(1-phenyl-propyl)-6-propyl...) Show SMILES CCCC1(CCc2ccccc2)CC(=O)C(C(CC)c2ccccc2)C(=O)O1 Show InChI InChI=1S/C25H30O3/c1-3-16-25(17-15-19-11-7-5-8-12-19)18-22(26)23(24(27)28-25)21(4-2)20-13-9-6-10-14-20/h5-14,21,23H,3-4,15-18H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia & Upjohn Curated by ChEMBL					Assay Description HIV Protease inhibitory activity				J Med Chem 39: 4630-42 (1996) Article DOI: 10.1021/jm960228q BindingDB Entry DOI: 10.7270/Q247490H
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50054619 (4-Hydroxy-6-phenethyl-3-(1-phenyl-propyl)-6-propyl...) Show SMILES CCCC1(CCc2ccccc2)CC(=O)C(C(CC)c2ccccc2)C(=O)O1 Show InChI InChI=1S/C25H30O3/c1-3-16-25(17-15-19-11-7-5-8-12-19)18-22(26)23(24(27)28-25)21(4-2)20-13-9-6-10-14-20/h5-14,21,23H,3-4,15-18H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibitory concentration against human immunodeficiency virus 1 protease in MT-4 cells				Bioorg Med Chem Lett 15: 3257-62 (2005) Article DOI: 10.1016/j.bmcl.2005.04.057 BindingDB Entry DOI: 10.7270/Q20V8C9V
					More data for this Ligand-Target Pair