Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM93025'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM93025 (CB2 Inhibitor, 1) Show SMILES CCCCCC(C)C(C)c1cc(O)c2C3=C(CCN(C3)C#C)C(C)(C)Oc2c1 |t:14| Show InChI InChI=1S/C25H35NO2/c1-7-9-10-11-17(3)18(4)19-14-22(27)24-20-16-26(8-2)13-12-21(20)25(5,6)28-23(24)15-19/h2,14-15,17-18,27H,7,9-13,16H2,1,3-6H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.30	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
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