Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 412.2 BDBM50159653

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50159653 (CHEMBL3785387) Show SMILES Cc1cccnc1C(=O)Nc1ccc(N2Cc3c(cccc3Cl)C2=O)c(Cl)c1 Show InChI InChI=1S/C21H15Cl2N3O2/c1-12-4-3-9-24-19(12)20(27)25-13-7-8-18(17(23)10-13)26-11-15-14(21(26)28)5-2-6-16(15)22/h2-10H,11H2,1H3,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Positive allosteric modulatory activity at human mGlu1 receptor expressed in wild type T-Rex293 cells assessed as increase in glutamate-induced calci...				Bioorg Med Chem Lett 26: 1869-72 (2016) Article DOI: 10.1016/j.bmcl.2016.03.031 BindingDB Entry DOI: 10.7270/Q2Z03B11
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM50159653 (CHEMBL3785387) Show SMILES Cc1cccnc1C(=O)Nc1ccc(N2Cc3c(cccc3Cl)C2=O)c(Cl)c1 Show InChI InChI=1S/C21H15Cl2N3O2/c1-12-4-3-9-24-19(12)20(27)25-13-7-8-18(17(23)10-13)26-11-15-14(21(26)28)5-2-6-16(15)22/h2-10H,11H2,1H3,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.45E+3	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Positive allosteric modulatory activity at human mGlu1 receptor expressed in wild type T-Rex293 cells assessed as increase in glutamate-induced calci...				Bioorg Med Chem Lett 26: 1869-72 (2016) Article DOI: 10.1016/j.bmcl.2016.03.031 BindingDB Entry DOI: 10.7270/Q2Z03B11
					More data for this Ligand-Target Pair