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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostasin' and Ligand = 'BDBM50246994'   
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
Prostasin


(Homo sapiens (Human))		BDBM50246994
PNG
(CHEMBL443101 | benzyl (R)-1-((2S,4R)-2-(((S)-6-ami...)
Show SMILES NCCCC[C@H](NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H](CCc1ccccc1)NC(=O)OCc1ccccc1)OCc1cccc(c1)C(F)(F)F)C(=O)c1nc2ccccc2o1 |r|
Show InChI InChI=1S/C44H46F3N5O7/c45-44(46,47)32-17-11-16-31(24-32)28-57-33-25-37(40(54)49-35(19-9-10-23-48)39(53)41-50-34-18-7-8-20-38(34)59-41)52(26-33)42(55)36(22-21-29-12-3-1-4-13-29)51-43(56)58-27-30-14-5-2-6-15-30/h1-8,11-18,20,24,33,35-37H,9-10,19,21-23,25-28,48H2,(H,49,54)(H,51,56)/t33-,35+,36-,37+/m1/s1
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Article
PubMed
 41n/an/an/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Binding affinity to human prostasin

Bioorg Med Chem Lett 18: 5895-9 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.029
BindingDB Entry DOI: 10.7270/Q2959HD4
More data for this
Ligand-Target Pair