Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptase beta-2' and Ligand = 'BDBM50152195'   

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))	BDBM50152195 (CHEMBL187168 | N-(3-Aminomethyl-phenyl)-2-[3-(4-be...) Show SMILES Cc1c(Cl)nc(N2CCC(CC2)n2cnc3ccccc23)c(=O)n1CC(=O)Nc1cccc(CN)c1 Show InChI InChI=1S/C26H28ClN7O2/c1-17-24(27)31-25(26(36)33(17)15-23(35)30-19-6-4-5-18(13-19)14-28)32-11-9-20(10-12-32)34-16-29-21-7-2-3-8-22(21)34/h2-8,13,16,20H,9-12,14-15,28H2,1H3,(H,30,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.24E+3	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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