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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50098097   
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
Neutrophil elastase


(Homo sapiens (Human))		BDBM50098097
PNG
((3R,3aS,6aR)-1-Methanesulfonyl-5-(3-piperidin-1-yl...)
Show SMILES CCC[C@@H]1[C@H]2CN(C[C@@H]2N(C1=O)S(C)(=O)=O)C(=O)CCN1CCCCC1
Show InChI InChI=1S/C18H31N3O4S/c1-3-7-14-15-12-20(13-16(15)21(18(14)23)26(2,24)25)17(22)8-11-19-9-5-4-6-10-19/h14-16H,3-13H2,1-2H3/t14-,15-,16+/m1/s1
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MMDB

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PubMed
n/an/a 120n/an/an/an/an/an/a



GlaxoWellcome Medicines Research Centre

Curated by ChEMBL


Assay Description
Inhibitory concentration against Elastase

Bioorg Med Chem Lett 11: 895-8 (2001)


BindingDB Entry DOI: 10.7270/Q29C6XZ6
More data for this
Ligand-Target Pair