BDBM50401053 CHEMBL2206844

SMILES: CCCn1cc(C(=O)c2cccc3cccc(Br)c23)c2ccccc12

InChI Key: InChIKey=NNIWGZLDWMKECV-UHFFFAOYSA-N

Data: 2 KI

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 = 50401053   

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 2 (Homo sapiens (Human))	BDBM50401053 (CHEMBL2206844) Show SMILES CCCn1cc(C(=O)c2cccc3cccc(Br)c23)c2ccccc12 Show InChI InChI=1S/C22H18BrNO/c1-2-13-24-14-18(16-9-3-4-12-20(16)24)22(25)17-10-5-7-15-8-6-11-19(23)21(15)17/h3-12,14H,2,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	192	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells after 1 hr by liquid scintillation spectrophotometry				Bioorg Med Chem 20: 2067-81 (2012) Article DOI: 10.1016/j.bmc.2012.01.038 BindingDB Entry DOI: 10.7270/Q2PG1SW6
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50401053 (CHEMBL2206844) Show SMILES CCCn1cc(C(=O)c2cccc3cccc(Br)c23)c2ccccc12 Show InChI InChI=1S/C22H18BrNO/c1-2-13-24-14-18(16-9-3-4-12-20(16)24)22(25)17-10-5-7-15-8-6-11-19(23)21(15)17/h3-12,14H,2,13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in HEK293 cells after 1 hr by liquid scintillation spectrophotometry				Bioorg Med Chem 20: 2067-81 (2012) Article DOI: 10.1016/j.bmc.2012.01.038 BindingDB Entry DOI: 10.7270/Q2PG1SW6
					More data for this Ligand-Target Pair