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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine protease 1/Trypsin-2' and Ligand = 'BDBM50087989'   
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
Serine protease 1/Trypsin-2


(Homo sapiens (Human))		BDBM50087989
PNG
(CHEMBL53755 | N-Diaminomethylene-4-fluoro-benzenes...)
Show SMILES NC(=N)NS(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C7H8FN3O2S/c8-5-1-3-6(4-2-5)14(12,13)11-7(9)10/h1-4H,(H4,9,10,11)
PDB

KEGG

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CHEMBL
PC cid
PC sid
UniChem
PubMed
 1.09E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi

Curated by ChEMBL


Assay Description
Inhibitory activity against human trypsin (using Chromozym TH as the substrate)

J Med Chem 43: 1793-806 (2000)


BindingDB Entry DOI: 10.7270/Q2NZ88B0
More data for this
Ligand-Target Pair