Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50432191'   

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))	BDBM50432191 (CHEMBL391430) Show SMILES OC1C2CCN(CC2)\C1=C/c1cn(Cc2ccc(Cl)cc2)c2ccccc12 |TLB:9:8:4.3:6.7,THB:0:1:4.3:6.7,(28.32,-6.52,;28.34,-8.06,;29.63,-9.01,;29.78,-10.49,;28.71,-11.42,;28.58,-9.92,;30.35,-9.2,;31.09,-8.26,;27.24,-8.92,;25.7,-8.93,;24.94,-10.27,;25.85,-11.53,;24.94,-12.78,;25.71,-14.11,;27.25,-14.11,;28.01,-15.45,;29.55,-15.45,;30.32,-14.11,;31.86,-14.11,;29.54,-12.78,;28.01,-12.78,;23.46,-12.3,;22.13,-13.07,;20.79,-12.3,;20.8,-10.76,;22.13,-9.99,;23.46,-10.75,)| Show InChI InChI=1S/C23H23ClN2O/c24-19-7-5-16(6-8-19)14-26-15-18(20-3-1-2-4-21(20)26)13-22-23(27)17-9-11-25(22)12-10-17/h1-8,13,15,17,23,27H,9-12,14H2/b22-13-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	85	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Displacement of [3H]CP 55940 from CB1 receptor in mouse whole brain membrane homogenates after 90 mins by liquid scintillation counting				Bioorg Med Chem Lett 23: 2019-21 (2013) Article DOI: 10.1016/j.bmcl.2013.02.025 BindingDB Entry DOI: 10.7270/Q2WS8VM2
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