Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptase beta-2' and Ligand = 'BDBM50152198'   

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
Tryptase beta-2 (Homo sapiens (Human))	BDBM50152198 (2-[3-(4-Amino-cyclohexylamino)-5-chloro-6-methyl-2...) Show SMILES Cc1c(Cl)nc(NC2CC[C@H](N)CC2)c(=O)n1CC(=O)Nc1cccc(CN)c1 |wU:10.10,(.97,.46,;-.37,-.31,;-1.7,.46,;-1.72,2,;-3.03,-.31,;-3.03,-1.86,;-4.39,-2.63,;-5.72,-1.86,;-5.7,-.31,;-7.03,.46,;-8.36,-.31,;-9.72,.46,;-8.39,-1.86,;-7.05,-2.63,;-1.7,-2.63,;-1.7,-4.17,;-.37,-1.86,;.97,-2.63,;2.3,-1.86,;2.3,-.31,;3.66,-2.63,;4.99,-1.86,;4.96,-.31,;6.3,.46,;7.65,-.31,;7.65,-1.86,;8.99,-2.63,;10.32,-1.86,;6.32,-2.63,)| Show InChI InChI=1S/C20H27ClN6O2/c1-12-18(21)26-19(25-15-7-5-14(23)6-8-15)20(29)27(12)11-17(28)24-16-4-2-3-13(9-16)10-22/h2-4,9,14-15H,5-8,10-11,22-23H2,1H3,(H,24,28)(H,25,26)/t14-,15?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	138	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aventis Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity against human Tryptase beta 2 expressed in yeast cells				Bioorg Med Chem Lett 14: 4819-23 (2004) Article DOI: 10.1016/j.bmcl.2004.07.051 BindingDB Entry DOI: 10.7270/Q2H994NZ
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