Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50600953'   

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 (Homo sapiens (Human))	BDBM50600953 (CHEMBL5181324) Show SMILES C[C@H]1CC[C@H](CC1)NC(=O)c1cc2cccnc2n(CCOCCF)c1=O |r,wD:4.7,1.0,(6.66,6.16,;5.33,5.39,;4,6.16,;2.66,5.39,;2.66,3.85,;4,3.08,;5.33,3.85,;1.33,3.08,;-0,3.85,;-0,5.39,;-1.34,3.08,;-2.67,3.85,;-4,3.08,;-5.33,3.85,;-6.66,3.08,;-6.66,1.54,;-5.33,.77,;-4,1.54,;-2.66,.77,;-2.66,-.77,;-4,-1.54,;-4,-3.08,;-5.33,-3.85,;-5.33,-5.39,;-6.66,-6.16,;-1.33,1.55,;-0,.78,)| Show InChI	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c00256 BindingDB Entry DOI: 10.7270/Q2Z89HGZ
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