Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM463872'   

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 1 (Mus musculus (Mouse))	BDBM463872 (US10787419, Serial # 72) Show SMILES CC(=O)NC(=N)C(=N/S(=O)(=O)c1ccc(cc1)C(F)(F)F)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:25| Show InChI InChI=1S/C26H21ClF3N5O3S/c1-16(36)32-24(31)25(34-39(37,38)21-13-9-19(10-14-21)26(28,29)30)35-15-22(17-5-3-2-4-6-17)23(33-35)18-7-11-20(27)12-8-18/h2-14,22H,15H2,1H3,(H2,31,32,36)/b34-25+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The United States of America, as represented by the Secretary, Department of Health and Human Services US Patent					Assay Description Measuring its tissue levels 1 hour after administration of 10 mg/kg to mice, plasma levels were comparable after oral or i.p. administration (indicat...				US Patent US10787419 (2020) BindingDB Entry DOI: 10.7270/Q2HH6P4S
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