Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dimer of Tryptase beta-2' and Ligand = 'BDBM50187175'   

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
Dimer of Tryptase beta-2 (Homo sapiens (Human))	BDBM50187175 ((S)-benzyl 6-amino-1-oxo-1-(5-((4-(3-phenylpropyl)...) Show SMILES NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1noc(CN2CCN(CCCc3ccccc3)CC2)n1 Show InChI InChI=1S/C30H40N6O4/c31-16-8-7-15-26(32-30(38)39-23-25-12-5-2-6-13-25)28(37)29-33-27(40-34-29)22-36-20-18-35(19-21-36)17-9-14-24-10-3-1-4-11-24/h1-6,10-13,26H,7-9,14-23,31H2,(H,32,38)/t26-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera Curated by ChEMBL					Assay Description Inhibition of human beta tryptase				Bioorg Med Chem Lett 16: 4036-40 (2006) Article DOI: 10.1016/j.bmcl.2006.05.009 BindingDB Entry DOI: 10.7270/Q20864ZV
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