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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptase beta-2/delta/gamma' and Ligand = 'BDBM50220825'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tryptase beta-2/delta/gamma


(Homo sapiens (Human))
BDBM50220825
PNG
(CHEMBL305950)
Show SMILES OC(=O)[C@@H]1[C@@H](CC2CCNCC2)C(=O)N1C(=O)Nc1ccccc1
Show InChI InChI=1S/C17H21N3O4/c21-15-13(10-11-6-8-18-9-7-11)14(16(22)23)20(15)17(24)19-12-4-2-1-3-5-12/h1-5,11,13-14,18H,6-10H2,(H,19,24)(H,22,23)/t13-,14+/m1/s1
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Article
PubMed
n/an/a 147n/an/an/an/an/an/a



The Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against human tryptase was determined


Bioorg Med Chem Lett 14: 2227-31 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.011
BindingDB Entry DOI: 10.7270/Q2GM86Q3
More data for this
Ligand-Target Pair