null

SMILES: Fc1cccc([C@H]2OC(=O)N[C@@H]2c2cncc(c2)C#Cc2ccccc2)c1F

InChI Key: InChIKey=YEASXMGLJOAINW-NHCUHLMSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50536702   

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
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50536702 (CHEMBL4554515) Show SMILES Fc1cccc([C@H]2OC(=O)N[C@@H]2c2cncc(c2)C#Cc2ccccc2)c1F |r| Show InChI InChI=1S/C22H14F2N2O2/c23-18-8-4-7-17(19(18)24)21-20(26-22(27)28-21)16-11-15(12-25-13-16)10-9-14-5-2-1-3-6-14/h1-8,11-13,20-21H,(H,26,27)/t20-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research & Development Curated by ChEMBL					Assay Description Displacement of [3H]-MPEPy from human mGluR5A transfected in HEK293 cell membranes after 60 mins by microbeta liquid scintillation counting analysis				Bioorg Med Chem Lett 26: 4165-9 (2016) Article DOI: 10.1016/j.bmcl.2016.07.065
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50536702 (CHEMBL4554515) Show SMILES Fc1cccc([C@H]2OC(=O)N[C@@H]2c2cncc(c2)C#Cc2ccccc2)c1F |r| Show InChI InChI=1S/C22H14F2N2O2/c23-18-8-4-7-17(19(18)24)21-20(26-22(27)28-21)16-11-15(12-25-13-16)10-9-14-5-2-1-3-6-14/h1-8,11-13,20-21H,(H,26,27)/t20-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research & Development Curated by ChEMBL					Assay Description Agonist activity at human mGluR5A transfected in HEK293 cells assessed as induction of calcium release by FLIPR assay				Bioorg Med Chem Lett 26: 4165-9 (2016) Article DOI: 10.1016/j.bmcl.2016.07.065
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50536702 (CHEMBL4554515) Show SMILES Fc1cccc([C@H]2OC(=O)N[C@@H]2c2cncc(c2)C#Cc2ccccc2)c1F |r| Show InChI InChI=1S/C22H14F2N2O2/c23-18-8-4-7-17(19(18)24)21-20(26-22(27)28-21)16-11-15(12-25-13-16)10-9-14-5-2-1-3-6-14/h1-8,11-13,20-21H,(H,26,27)/t20-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.20	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research & Development Curated by ChEMBL					Assay Description Positive allosteric modulation of human mGluR5A transfected in HEK293 cells assessed as potentiation of L-glutamate-induced calcium release incubated...				Bioorg Med Chem Lett 26: 4165-9 (2016) Article DOI: 10.1016/j.bmcl.2016.07.065
					More data for this Ligand-Target Pair