BDBM50436516 CHEMBL2397373

SMILES: C[C@@H]1CN(CCN1c1ncccn1)C(=O)C12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=KVTATCIMKKPVLU-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 = 50436516   

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))	BDBM50436516 (CHEMBL2397373) Show SMILES C[C@@H]1CN(CCN1c1ncccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20| Show InChI InChI=1S/C20H28N4O/c1-14-13-23(5-6-24(14)19-21-3-2-4-22-19)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/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	>1.00E+4	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))	BDBM50436516 (CHEMBL2397373) Show SMILES C[C@@H]1CN(CCN1c1ncccn1)C(=O)C12CC3CC(CC(C3)C1)C2 |r,TLB:13:15:18.17.22:20,THB:16:17:20:24.15.23,16:15:18.17.22:20,23:15:18:22.21.20,23:21:18:24.16.15,13:15:18:22.21.20| Show InChI InChI=1S/C20H28N4O/c1-14-13-23(5-6-24(14)19-21-3-2-4-22-19)18(25)20-10-15-7-16(11-20)9-17(8-15)12-20/h2-4,14-17H,5-13H2,1H3/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	>1.00E+4	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