Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM463833'   

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))	BDBM463833 (US10787419, Serial # 42 | US10787419, Serial # 43) Show SMILES COCCN(C)C(=N)C(=N/S(=O)(=O)c1ccc(Cl)cc1)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:24| Show InChI InChI=1S/C27H27Cl2N5O3S/c1-33(16-17-37-2)26(30)27(32-38(35,36)23-14-12-22(29)13-15-23)34-18-24(19-6-4-3-5-7-19)25(31-34)20-8-10-21(28)11-9-20/h3-15,24,30H,16-18H2,1-2H3/b30-26?,32-27+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	23	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
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM463833 (US10787419, Serial # 42 | US10787419, Serial # 43) Show SMILES COCCN(C)C(=N)C(=N/S(=O)(=O)c1ccc(Cl)cc1)\N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |c:24| Show InChI InChI=1S/C27H27Cl2N5O3S/c1-33(16-17-37-2)26(30)27(32-38(35,36)23-14-12-22(29)13-15-23)34-18-24(19-6-4-3-5-7-19)25(31-34)20-8-10-21(28)11-9-20/h3-15,24,30H,16-18H2,1-2H3/b30-26?,32-27+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	908	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
					More data for this Ligand-Target Pair