BDBM174146 US9688669, Example 19::US9688669, Example 20::US9688669, Example 21

SMILES: CCC(O)CC#Cc1cncc(c1)[C@H]1NC(=O)O[C@@H]1c1cccc(F)c1

InChI Key: InChIKey=HPCWBLWTSKYMKP-OMKBGSMGSA-N

Data: 3 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 3 hits for monomerid = 174146   

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 (mGluR5) (Homo sapiens (Human))	BDBM174146 (US9688669, Example 19 | US9688669, Example 20 | US...) Show SMILES CCC(O)CC#Cc1cncc(c1)[C@H]1NC(=O)O[C@@H]1c1cccc(F)c1 |r| Show InChI InChI=1S/C20H19FN2O3/c1-2-17(24)8-3-5-13-9-15(12-22-11-13)18-19(26-20(25)23-18)14-6-4-7-16(21)10-14/h4,6-7,9-12,17-19,24H,2,8H2,1H3,(H,23,25)/t17?,18-,19-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	28	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description HEK293 (ZF) cells stably transfected with human mGluR5A (pIRES neo) and the rat glutamate-aspartate transporter (GLAST; pIRES puro) are grown in a mo...				US Patent US9688669 (2017) BindingDB Entry DOI: 10.7270/Q25T3HN9
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (mGluR5) (Homo sapiens (Human))	BDBM174146 (US9688669, Example 19 | US9688669, Example 20 | US...) Show SMILES CCC(O)CC#Cc1cncc(c1)[C@H]1NC(=O)O[C@@H]1c1cccc(F)c1 |r| Show InChI InChI=1S/C20H19FN2O3/c1-2-17(24)8-3-5-13-9-15(12-22-11-13)18-19(26-20(25)23-18)14-6-4-7-16(21)10-14/h4,6-7,9-12,17-19,24H,2,8H2,1H3,(H,23,25)/t17?,18-,19-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description HEK293 (ZF) cells stably transfected with human mGluR5A (pIRES neo) and the rat glutamate-aspartate transporter (GLAST; pIRES puro) are grown in a mo...				US Patent US9688669 (2017) BindingDB Entry DOI: 10.7270/Q25T3HN9
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (mGluR5) (Homo sapiens (Human))	BDBM174146 (US9688669, Example 19 | US9688669, Example 20 | US...) Show SMILES CCC(O)CC#Cc1cncc(c1)[C@H]1NC(=O)O[C@@H]1c1cccc(F)c1 |r| Show InChI InChI=1S/C20H19FN2O3/c1-2-17(24)8-3-5-13-9-15(12-22-11-13)18-19(26-20(25)23-18)14-6-4-7-16(21)10-14/h4,6-7,9-12,17-19,24H,2,8H2,1H3,(H,23,25)/t17?,18-,19-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	61	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description HEK293 (ZF) cells stably transfected with human mGluR5A (pIRES neo) and the rat glutamate-aspartate transporter (GLAST; pIRES puro) are grown in a mo...				US Patent US9688669 (2017) BindingDB Entry DOI: 10.7270/Q25T3HN9
					More data for this Ligand-Target Pair