BDBM50362632 CHEMBL1939049

SMILES: CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1

InChI Key: InChIKey=JGSQJXUOKYUXPA-UHFFFAOYSA-N

Data: 2 EC50

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 = 50362632   

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
Hydroxycarboxylic acid receptor 2 (Rattus norvegicus)	BDBM50362632 (CHEMBL1939049) Show SMILES CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 Show InChI InChI=1S/C18H20N2O4/c1-2-3-4-10-23-18-19-16(22)15-13(7-5-6-12-8-9-12)11-14(21)24-17(15)20-18/h11-12H,2,5-10H2,1H3,(H,19,20,22)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	83	n/a	n/a	n/a	n/a
Merck Research Laboratory Curated by ChEMBL					Assay Description Agonist activity at rat nicotinic acid receptor				Bioorg Med Chem Lett 22: 854-8 (2012) Article DOI: 10.1016/j.bmcl.2011.12.041 BindingDB Entry DOI: 10.7270/Q24B31S5
					More data for this Ligand-Target Pair
Hydroxycarboxylic acid receptor 2 (Homo sapiens (Human))	BDBM50362632 (CHEMBL1939049) Show SMILES CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 Show InChI InChI=1S/C18H20N2O4/c1-2-3-4-10-23-18-19-16(22)15-13(7-5-6-12-8-9-12)11-14(21)24-17(15)20-18/h11-12H,2,5-10H2,1H3,(H,19,20,22)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	67	n/a	n/a	n/a	n/a
Merck Research Laboratory Curated by ChEMBL					Assay Description Agonist activity at human HM74A				Bioorg Med Chem Lett 22: 854-8 (2012) Article DOI: 10.1016/j.bmcl.2011.12.041 BindingDB Entry DOI: 10.7270/Q24B31S5
					More data for this Ligand-Target Pair