Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1-antitrypsin' and Ligand = 'BDBM629216'   

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)	BDBM629216 (US20230339915, Compound 141) Show SMILES CC(C)c1c([C@H]2C[C@@H](C2)C(O)=O)c2cc(O)ccc2n1-c1ccc(F)c(F)c1 |r,wU:5.4,wD:7.9,(3.97,1.16,;3.18,-.17,;3.93,-1.51,;1.64,-.17,;.74,1.07,;1.24,2.53,;.47,3.86,;1.8,4.63,;2.57,3.3,;2.3,6.09,;3.82,6.38,;1.3,7.25,;-.73,.6,;-2.06,1.37,;-3.39,.6,;-4.75,1.33,;-3.39,-.94,;-2.06,-1.71,;-.73,-.94,;.74,-1.42,;1.23,-2.88,;.23,-4.05,;.74,-5.5,;2.25,-5.79,;2.73,-7.25,;3.25,-4.62,;4.75,-4.99,;2.75,-3.16,)| 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