BDBM50364097 CHEMBL1950923

SMILES: CCS(=O)(=O)c1ccc2n(CC3CCN(CC3)C(C)=O)c(nc2c1)C(C)(C)C

InChI Key: InChIKey=FJTPINLYFOCQFC-UHFFFAOYSA-N

Data: 2 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 = 50364097   

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))	BDBM50364097 (CHEMBL1950923) Show SMILES CCS(=O)(=O)c1ccc2n(CC3CCN(CC3)C(C)=O)c(nc2c1)C(C)(C)C Show InChI InChI=1S/C21H31N3O3S/c1-6-28(26,27)17-7-8-19-18(13-17)22-20(21(3,4)5)24(19)14-16-9-11-23(12-10-16)15(2)25/h7-8,13,16H,6,9-12,14H2,1-5H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	8.40	n/a	n/a	n/a	n/a
Janssen Research& Development Curated by ChEMBL					Assay Description Agonist activity at human CB2 receptor				Bioorg Med Chem Lett 22: 547-52 (2011) Article DOI: 10.1016/j.bmcl.2011.10.091 BindingDB Entry DOI: 10.7270/Q2JW8FBF
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50364097 (CHEMBL1950923) Show SMILES CCS(=O)(=O)c1ccc2n(CC3CCN(CC3)C(C)=O)c(nc2c1)C(C)(C)C Show InChI InChI=1S/C21H31N3O3S/c1-6-28(26,27)17-7-8-19-18(13-17)22-20(21(3,4)5)24(19)14-16-9-11-23(12-10-16)15(2)25/h7-8,13,16H,6,9-12,14H2,1-5H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Janssen Research& Development Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor				Bioorg Med Chem Lett 22: 547-52 (2011) Article DOI: 10.1016/j.bmcl.2011.10.091 BindingDB Entry DOI: 10.7270/Q2JW8FBF
					More data for this Ligand-Target Pair