BDBM50156027 CHEMBL3781330

SMILES: CC(C)c1ccc2n(CCN3CCS(=O)(=O)CC3)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1

InChI Key: InChIKey=WEYIIJLTOPJEDN-BRDUYFECSA-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 = 50156027   

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))	BDBM50156027 (CHEMBL3781330) Show SMILES CC(C)c1ccc2n(CCN3CCS(=O)(=O)CC3)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:30:29:32:26.25.24,30:25:32:29.31.28,THB:28:29:26.27.32:24,28:27:24:29.31.30| Show InChI InChI=1S/C30H35NO11S/c1-13(32)38-23-24(39-14(2)33)26(40-15(3)34)29(42-25(23)28(35)36)43-20-9-7-17-18-12-16-6-8-19(37-5)22-21(16)30(17,27(20)41-22)10-11-31(18)4/h6-9,17-18,20,23-27,29H,10-12H2,1-5H3,(H,35,36)/t17-,18+,20?,23?,24?,25?,26?,27-,29?,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.93E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins by Competition binding assay				J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50156027 (CHEMBL3781330) Show SMILES CC(C)c1ccc2n(CCN3CCS(=O)(=O)CC3)cc(C(=O)NC34CC5CC(CC(C5)C3)C4)c(=O)c2c1 |TLB:30:29:32:26.25.24,30:25:32:29.31.28,THB:28:29:26.27.32:24,28:27:24:29.31.30| Show InChI InChI=1S/C30H35NO11S/c1-13(32)38-23-24(39-14(2)33)26(40-15(3)34)29(42-25(23)28(35)36)43-20-9-7-17-18-12-16-6-8-19(37-5)22-21(16)30(17,27(20)41-22)10-11-31(18)4/h6-9,17-18,20,23-27,29H,10-12H2,1-5H3,(H,35,36)/t17-,18+,20?,23?,24?,25?,26?,27-,29?,30-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins by Competition binding assay				J Med Chem 59: 1052-67 (2016) BindingDB Entry DOI: 10.7270/Q2GB25XB
					More data for this Ligand-Target Pair