BDBM50384791 CHEMBL490162

SMILES: COc1cc(ccc1OC(=O)C(C)C)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1

InChI Key: InChIKey=IGCZWOGVHOOOEO-INIZCTEOSA-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 = 50384791   

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
Taste receptor type 2 member 31 (Homo sapiens (Human))	BDBM50384791 (CHEMBL490162) Show SMILES COc1cc(ccc1OC(=O)C(C)C)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r| Show InChI InChI=1S/C20H20O7/c1-10(2)20(24)27-15-5-4-11(6-17(15)25-3)16-9-14(23)19-13(22)7-12(21)8-18(19)26-16/h4-8,10,16,21-22H,9H2,1-3H3/t16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of human TAS2R31 receptor expressed in HEK293T cells overexpressing chimeric G-protein alpha-subunit				J Nat Prod 74: 1539-55 (2011) Article DOI: 10.1021/np200391c BindingDB Entry DOI: 10.7270/Q28K7B4J
					More data for this Ligand-Target Pair