BDBM50257520 CHEMBL4074421

SMILES: O[C@H]1CC[C@@H](CC1)Nc1ccc(cc1Cl)-c1ccn2c(CC3CC3)nnc2c1Cl

InChI Key: InChIKey=SOTRPBHTXCSDMF-WKILWMFISA-N

Data: 1 KI  1 Kd  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 3 hits for monomerid = 50257520   

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 2 (Homo sapiens (Human))	BDBM50257520 (CHEMBL4074421) Show SMILES O[C@H]1CC[C@@H](CC1)Nc1ccc(cc1Cl)-c1ccn2c(CC3CC3)nnc2c1Cl |r,wU:4.7,wD:1.0,(23.64,-13.67,;23.65,-12.13,;24.99,-11.36,;25,-9.82,;23.66,-9.06,;22.33,-9.82,;22.32,-11.35,;23.67,-7.52,;25,-6.75,;26.33,-7.52,;27.67,-6.75,;27.67,-5.2,;26.33,-4.43,;25,-5.2,;23.67,-4.43,;28.99,-4.42,;30.33,-5.19,;31.65,-4.42,;31.66,-2.88,;32.8,-1.84,;34.3,-2.16,;34.78,-3.62,;34.47,-5.12,;35.94,-4.64,;32.16,-.44,;30.63,-.61,;30.32,-2.11,;28.98,-2.88,;27.65,-2.12,)| Show InChI InChI=1S/C22H24Cl2N4O/c23-18-12-14(3-8-19(18)25-15-4-6-16(29)7-5-15)17-9-10-28-20(11-13-1-2-13)26-27-22(28)21(17)24/h3,8-10,12-13,15-16,25,29H,1-2,4-7,11H2/t15-,16-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research (LACDR), Leiden University , P.O. Box 9502, 2300RA Leiden, The Netherlands. Curated by ChEMBL					Assay Description Displacement of [3H]-JNJ46281222 from human metabotropic glutamate receptor 2 expressed in CHOK1 cell membranes after 60 mins by microbeta counting a...				J Med Chem 60: 6704-6720 (2017) Article DOI: 10.1021/acs.jmedchem.7b00669 BindingDB Entry DOI: 10.7270/Q24B33RJ
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50257520 (CHEMBL4074421) Show SMILES O[C@H]1CC[C@@H](CC1)Nc1ccc(cc1Cl)-c1ccn2c(CC3CC3)nnc2c1Cl |r,wU:4.7,wD:1.0,(23.64,-13.67,;23.65,-12.13,;24.99,-11.36,;25,-9.82,;23.66,-9.06,;22.33,-9.82,;22.32,-11.35,;23.67,-7.52,;25,-6.75,;26.33,-7.52,;27.67,-6.75,;27.67,-5.2,;26.33,-4.43,;25,-5.2,;23.67,-4.43,;28.99,-4.42,;30.33,-5.19,;31.65,-4.42,;31.66,-2.88,;32.8,-1.84,;34.3,-2.16,;34.78,-3.62,;34.47,-5.12,;35.94,-4.64,;32.16,-.44,;30.63,-.61,;30.32,-2.11,;28.98,-2.88,;27.65,-2.12,)| Show InChI InChI=1S/C22H24Cl2N4O/c23-18-12-14(3-8-19(18)25-15-4-6-16(29)7-5-15)17-9-10-28-20(11-13-1-2-13)26-27-22(28)21(17)24/h3,8-10,12-13,15-16,25,29H,1-2,4-7,11H2/t15-,16-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a
Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research (LACDR), Leiden University , P.O. Box 9502, 2300RA Leiden, The Netherlands. Curated by ChEMBL					Assay Description Binding affinity to human metabotropic glutamate receptor 2 expressed in CHOK1 cell membranes by scintillation proximity assay				J Med Chem 60: 6704-6720 (2017) Article DOI: 10.1021/acs.jmedchem.7b00669 BindingDB Entry DOI: 10.7270/Q24B33RJ
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50257520 (CHEMBL4074421) Show SMILES O[C@H]1CC[C@@H](CC1)Nc1ccc(cc1Cl)-c1ccn2c(CC3CC3)nnc2c1Cl |r,wU:4.7,wD:1.0,(23.64,-13.67,;23.65,-12.13,;24.99,-11.36,;25,-9.82,;23.66,-9.06,;22.33,-9.82,;22.32,-11.35,;23.67,-7.52,;25,-6.75,;26.33,-7.52,;27.67,-6.75,;27.67,-5.2,;26.33,-4.43,;25,-5.2,;23.67,-4.43,;28.99,-4.42,;30.33,-5.19,;31.65,-4.42,;31.66,-2.88,;32.8,-1.84,;34.3,-2.16,;34.78,-3.62,;34.47,-5.12,;35.94,-4.64,;32.16,-.44,;30.63,-.61,;30.32,-2.11,;28.98,-2.88,;27.65,-2.12,)| Show InChI InChI=1S/C22H24Cl2N4O/c23-18-12-14(3-8-19(18)25-15-4-6-16(29)7-5-15)17-9-10-28-20(11-13-1-2-13)26-27-22(28)21(17)24/h3,8-10,12-13,15-16,25,29H,1-2,4-7,11H2/t15-,16-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	33	n/a	n/a	n/a	n/a
Division of Medicinal Chemistry, Leiden Academic Centre for Drug Research (LACDR), Leiden University , P.O. Box 9502, 2300RA Leiden, The Netherlands. Curated by ChEMBL					Assay Description Displacement of [3H]-JNJ46281222 from human metabotropic glutamate receptor 2 expressed in CHOK1 cell membranes after 60 mins by liquid scintillation...				J Med Chem 60: 6704-6720 (2017) Article DOI: 10.1021/acs.jmedchem.7b00669 BindingDB Entry DOI: 10.7270/Q24B33RJ
					More data for this Ligand-Target Pair