Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hepatitis A virus cellular receptor 2' and Ligand = 'BDBM50579438'   

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
Hepatitis A virus cellular receptor 2 (Homo sapiens)	BDBM50579438 (CHEMBL4854485) Show SMILES Nc1ccc(cc1)-c1nn2cnnc2s1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	7.40E+5	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to human TIM-3 IgV domain (residues 22 to 130) expressed in Escherichia coli BL21 (DE3) by 1H-15N SOFAST-HMQC spectroscopic analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c01336 BindingDB Entry DOI: 10.7270/Q20V8HMJ
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