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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine protease 1' and Ligand = 'BDBM50103667'   
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


(Homo sapiens (Human))		BDBM50103667
PNG
(2-(3-Carbamimidoyl-phenoxy)-N-(3-fluoro-4-morpholi...)
Show SMILES NC(=N)c1cccc(OC(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c2ccccc2)c1
Show InChI InChI=1S/C25H25FN4O3/c26-21-16-19(9-10-22(21)30-11-13-32-14-12-30)29-25(31)23(17-5-2-1-3-6-17)33-20-8-4-7-18(15-20)24(27)28/h1-10,15-16,23H,11-14H2,(H3,27,28)(H,29,31)
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PC cid
PC sid
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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



COR Therapeutics, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against trypsin

Bioorg Med Chem Lett 11: 2279-82 (2001)


BindingDB Entry DOI: 10.7270/Q2SQ8ZN4
More data for this
Ligand-Target Pair