BDBM50222812 CHEMBL399949::N-butyl-2-cyclopentyl-4-(ethylsulfonyl)-N-methyl-1,2,3,4-tetrahydropyrrolo[3,4-b]indole-7-carboxamide

SMILES: CCCCN(C)C(=O)c1ccc2n(c3CN(Cc3c2c1)C1CCCC1)S(=O)(=O)CC

InChI Key: InChIKey=OZLHJBSTXWDJKT-UHFFFAOYSA-N

Data: 2 KI  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 = 50222812   

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))	BDBM50222812 (CHEMBL399949 | N-butyl-2-cyclopentyl-4-(ethylsulfo...) Show SMILES CCCCN(C)C(=O)c1ccc2n(c3CN(Cc3c2c1)C1CCCC1)S(=O)(=O)CC Show InChI InChI=1S/C23H33N3O3S/c1-4-6-13-24(3)23(27)17-11-12-21-19(14-17)20-15-25(18-9-7-8-10-18)16-22(20)26(21)30(28,29)5-2/h11-12,14,18H,4-10,13,15-16H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Binding affinity to human CB2 receptor				Bioorg Med Chem Lett 17: 6183-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.019 BindingDB Entry DOI: 10.7270/Q2TH8MD3
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50222812 (CHEMBL399949 | N-butyl-2-cyclopentyl-4-(ethylsulfo...) Show SMILES CCCCN(C)C(=O)c1ccc2n(c3CN(Cc3c2c1)C1CCCC1)S(=O)(=O)CC Show InChI InChI=1S/C23H33N3O3S/c1-4-6-13-24(3)23(27)17-11-12-21-19(14-17)20-15-25(18-9-7-8-10-18)16-22(20)26(21)30(28,29)5-2/h11-12,14,18H,4-10,13,15-16H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	779	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Binding affinity to human CB1 receptor				Bioorg Med Chem Lett 17: 6183-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.019 BindingDB Entry DOI: 10.7270/Q2TH8MD3
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50222812 (CHEMBL399949 | N-butyl-2-cyclopentyl-4-(ethylsulfo...) Show SMILES CCCCN(C)C(=O)c1ccc2n(c3CN(Cc3c2c1)C1CCCC1)S(=O)(=O)CC Show InChI InChI=1S/C23H33N3O3S/c1-4-6-13-24(3)23(27)17-11-12-21-19(14-17)20-15-25(18-9-7-8-10-18)16-22(20)26(21)30(28,29)5-2/h11-12,14,18H,4-10,13,15-16H2,1-3H3	PDB 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	4	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Agonist activity at human CB2 receptor by GTPgamma[35S] assay				Bioorg Med Chem Lett 17: 6183-7 (2007) Article DOI: 10.1016/j.bmcl.2007.09.019 BindingDB Entry DOI: 10.7270/Q2TH8MD3
					More data for this Ligand-Target Pair