BDBM50436495 CHEMBL2397374

SMILES: C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccn1

InChI Key: InChIKey=PPMPVGYSGJQRGN-ZIUDEIKKSA-N

Data: 2 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 2 hits for monomerid = 50436495   

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 1 (Homo sapiens (Human))	BDBM50436495 (CHEMBL2397374) Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14| Show InChI InChI=1S/C20H28N4O/c1-14-13-23(18-12-21-2-3-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization				Bioorg Med Chem Lett 23: 3713-8 (2013) Article DOI: 10.1016/j.bmcl.2013.05.020 BindingDB Entry DOI: 10.7270/Q2Z60QGB
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM50436495 (CHEMBL2397374) Show SMILES C[C@@H]1CN(CCN1C(=O)C12CC3CC(CC(C3)C1)C2)c1cnccn1 |r,TLB:7:9:12.11.16:14,THB:10:11:14:18.9.17,10:9:12.11.16:14,17:9:12:16.15.14,17:15:12:18.10.9,7:9:12:16.15.14| Show InChI InChI=1S/C20H28N4O/c1-14-13-23(18-12-21-2-3-22-18)4-5-24(14)19(25)20-9-15-6-16(10-20)8-17(7-15)11-20/h2-3,12,14-17H,4-11,13H2,1H3/t14-,15?,16?,17?,20?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGluR1 expressed in HEK293A cells assessed as inhibition of glutamate-induced calcium mobilization				Bioorg Med Chem Lett 23: 3713-8 (2013) Article DOI: 10.1016/j.bmcl.2013.05.020 BindingDB Entry DOI: 10.7270/Q2Z60QGB
					More data for this Ligand-Target Pair