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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptase beta-2' and Ligand = 'BDBM50152205'   
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


(Homo sapiens (Human))
BDBM50152205
PNG
(2-[3-(3-Aminomethyl-benzylamino)-5-chloro-6-methyl...)
Show SMILES Cc1c(Cl)nc(NCc2cccc(CN)c2)c(=O)n1CC(=O)Nc1cccc(CN)c1
Show InChI InChI=1S/C22H25ClN6O2/c1-14-20(23)28-21(26-12-17-6-2-4-15(8-17)10-24)22(31)29(14)13-19(30)27-18-7-3-5-16(9-18)11-25/h2-9H,10-13,24-25H2,1H3,(H,26,28)(H,27,30)
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Similars

Article
PubMed
390n/an/an/an/an/an/an/an/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
More data for this
Ligand-Target Pair