BDBM93036 CB2 Inhibitor, 12

SMILES: CCCn1c(SCC(=O)NCC2COc3ccccc3O2)nc2sc3CCCc3c2c1=O

InChI Key: InChIKey=LRCUTGDNYLPLOI-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 93036   

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))	BDBM93036 (CB2 Inhibitor, 12) Show SMILES CCCn1c(SCC(=O)NCC2COc3ccccc3O2)nc2sc3CCCc3c2c1=O Show InChI InChI=1S/C23H25N3O4S2/c1-2-10-26-22(28)20-15-6-5-9-18(15)32-21(20)25-23(26)31-13-19(27)24-11-14-12-29-16-7-3-4-8-17(16)30-14/h3-4,7-8,14H,2,5-6,9-13H2,1H3,(H,24,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	6.09E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratoire de Chimie Thérapeutique					Assay Description Competitive binding assay using cannabinoid receptors.				Chem Biol Drug Des 81: 442-454 (2013) Article DOI: 10.1111/cbdd.12095 BindingDB Entry DOI: 10.7270/Q20000PK
					More data for this Ligand-Target Pair