BDBM50262555 9-(2-Hydroxy-4,4-dimethyl-6-oxocyclohexyl)-7-methoxy-3,3-dimethyl-2,3,4,9-tetrahydro-1H-xanthen-1-one::CHEMBL477578

SMILES: COc1ccc2OC3=C(C(C4C(=O)CC(C)(C)CC4=O)c2c1)C(=O)CC(C)(C)C3

InChI Key: InChIKey=VBXSQAHNAMJDFF-UHFFFAOYSA-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 = 50262555   

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
Neuropeptide Y receptor type 5 ( NPY Y5) (Homo sapiens (Human))	BDBM50262555 (9-(2-Hydroxy-4,4-dimethyl-6-oxocyclohexyl)-7-metho...) Show SMILES COc1ccc2OC3=C(C(C4C(=O)CC(C)(C)CC4=O)c2c1)C(=O)CC(C)(C)C3 |c:7| Show InChI InChI=1S/C24H28O5/c1-23(2)9-15(25)21(16(26)10-23)20-14-8-13(28-5)6-7-18(14)29-19-12-24(3,4)11-17(27)22(19)20/h6-8,20-21H,9-12H2,1-5H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	590	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]PYY from human recombinant neuropeptide Y5 receptor expressed in thymidine kinase deficient human LM cells				J Med Chem 51: 4765-70 (2008) Article DOI: 10.1021/jm8003587 BindingDB Entry DOI: 10.7270/Q2J96664
					More data for this Ligand-Target Pair