BDBM50267939 CHEMBL484478::cyclohexyl(3-(naphthalen-1-ylsulfonyl)-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone

SMILES: O=C(C1CCCCC1)N1C2CC1CN(C2)S(=O)(=O)c1cccc2ccccc12

InChI Key: InChIKey=DMYLIFKDVYIQAM-UHFFFAOYSA-N

Data: 1 IC50  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 2 hits for monomerid = 50267939   

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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50267939 (CHEMBL484478 | cyclohexyl(3-(naphthalen-1-ylsulfon...) Show SMILES O=C(C1CCCCC1)N1C2CC1CN(C2)S(=O)(=O)c1cccc2ccccc12 |THB:15:13:8:10| Show InChI InChI=1S/C22H26N2O3S/c25-22(17-8-2-1-3-9-17)24-18-13-19(24)15-23(14-18)28(26,27)21-12-6-10-16-7-4-5-11-20(16)21/h4-7,10-12,17-19H,1-3,8-9,13-15H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	900	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inverse agonist activity at human recombinant CB1R expressed in CHO cells assessed as increase in forskolin-stimulated cAMP level				J Med Chem 52: 2550-8 (2009) Article DOI: 10.1021/jm900063x BindingDB Entry DOI: 10.7270/Q2028RF8
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50267939 (CHEMBL484478 | cyclohexyl(3-(naphthalen-1-ylsulfon...) Show SMILES O=C(C1CCCCC1)N1C2CC1CN(C2)S(=O)(=O)c1cccc2ccccc12 |THB:15:13:8:10| Show InChI InChI=1S/C22H26N2O3S/c25-22(17-8-2-1-3-9-17)24-18-13-19(24)15-23(14-18)28(26,27)21-12-6-10-16-7-4-5-11-20(16)21/h4-7,10-12,17-19H,1-3,8-9,13-15H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank 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
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human recombinant CB1R expressed in CHO cells				J Med Chem 52: 2550-8 (2009) Article DOI: 10.1021/jm900063x BindingDB Entry DOI: 10.7270/Q2028RF8
					More data for this Ligand-Target Pair