BDBM50268972 CHEMBL4060899

SMILES: OC(=O)C1=C(CCCC1)NC(=O)CCC#Cc1ccc(O)cc1F

InChI Key: InChIKey=JJMDNSVHZBHZGM-UHFFFAOYSA-N

Data: 1 IC50  1 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 = 50268972   

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 (Homo sapiens (Human))	BDBM50268972 (CHEMBL4060899) Show SMILES OC(=O)C1=C(CCCC1)NC(=O)CCC#Cc1ccc(O)cc1F |t:3| Show InChI InChI=1S/C18H18FNO4/c19-15-11-13(21)10-9-12(15)5-1-4-8-17(22)20-16-7-3-2-6-14(16)18(23)24/h9-11,21H,2-4,6-8H2,(H,20,22)(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Latvian Institute of Organic Synthesis Curated by ChEMBL					Assay Description Displacement of [5,6-3H]-nicotinic acid from recombinant human HCA2 receptor expressed in Flp-IN HEK cell membranes after 2 hrs by microbeta counting...				Bioorg Med Chem 25: 4314-4329 (2017) Article DOI: 10.1016/j.bmc.2017.06.028 BindingDB Entry DOI: 10.7270/Q2D22140
					More data for this Ligand-Target Pair
Hydroxycarboxylic acid receptor 2 (Homo sapiens (Human))	BDBM50268972 (CHEMBL4060899) Show SMILES OC(=O)C1=C(CCCC1)NC(=O)CCC#Cc1ccc(O)cc1F |t:3| Show InChI InChI=1S/C18H18FNO4/c19-15-11-13(21)10-9-12(15)5-1-4-8-17(22)20-16-7-3-2-6-14(16)18(23)24/h9-11,21H,2-4,6-8H2,(H,20,22)(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	80	n/a	n/a	n/a	n/a
Latvian Institute of Organic Synthesis Curated by ChEMBL					Assay Description Agonist activity at recombinant human HCA2 receptor expressed in Flp-IN HEK cells assessed as reduction in forskolin-stimulated cAMP accumulation mea...				Bioorg Med Chem 25: 4314-4329 (2017) Article DOI: 10.1016/j.bmc.2017.06.028 BindingDB Entry DOI: 10.7270/Q2D22140
					More data for this Ligand-Target Pair