Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM463801'   

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))	BDBM463801 (US10787419, Serial # 13) Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=N\S(=O)(=O)c1ccc(Cl)cc1)\C(=N)COc1ccccc1 |t:8| Show InChI InChI=1S/C30H24Cl2N4O3S/c31-23-13-11-22(12-14-23)29-27(21-7-3-1-4-8-21)19-36(34-29)30(28(33)20-39-25-9-5-2-6-10-25)35-40(37,38)26-17-15-24(32)16-18-26/h1-18,27,33H,19-20H2/b33-28?,35-30+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	72	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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