Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1-antitrypsin' and Ligand = 'BDBM629215'   

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
Alpha-1-antitrypsin (Human)	BDBM629215 (6-(1-(4-fluoro-3-methylphenyl)-5-hydroxy-2-(triflu...) Show SMILES Cc1cc(ccc1F)-n1c(c(C2CC3(CC(C3)C(O)=O)C2)c2cc(O)ccc12)C(F)(F)F |w:15.18,(4.76,-6,;3.25,-5.68,;2.74,-4.23,;1.23,-3.95,;.22,-5.12,;.74,-6.57,;2.25,-6.85,;2.75,-8.31,;.72,-2.49,;1.63,-1.25,;.72,-0,;1.18,1.47,;.41,2.8,;1.74,3.57,;.97,4.91,;2.3,5.68,;3.07,4.34,;2.85,7.12,;4.37,7.37,;1.87,8.31,;2.51,2.24,;-.74,-.48,;-2.08,.29,;-3.41,-.48,;-4.76,.27,;-3.41,-2.02,;-2.08,-2.79,;-.74,-2.02,;3.17,-1.25,;3.94,.08,;4.71,-1.25,;3.92,-2.59,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair