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SMILES: CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2cc(C)nc(C)c2)c1=O)-c1ccccc1)C(=O)C(F)(F)F

InChI Key: InChIKey=PPKJSOZGHGROOV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50037364   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Neutrophil elastase


(Homo sapiens (Human))		BDBM50037364
PNG
(CHEMBL113187 | {2-Oxo-6-phenyl-1-[(3,3,3-trifluoro...)
Show SMILES CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2cc(C)nc(C)c2)c1=O)-c1ccccc1)C(=O)C(F)(F)F
Show InChI InChI=1S/C28H29F3N4O5/c1-16(2)24(25(37)28(29,30)31)34-23(36)14-35-22(20-8-6-5-7-9-20)11-10-21(26(35)38)33-27(39)40-15-19-12-17(3)32-18(4)13-19/h5-13,16,24H,14-15H2,1-4H3,(H,33,39)(H,34,36)
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Similars
PubMed
 4.10n/an/an/an/an/an/an/an/a



Zeneca Pharmaceuticals Group

Curated by ChEMBL


Assay Description
Binding affinity against human leukocyte elastase (HLE) enzyme

J Med Chem 37: 3313-26 (1994)


BindingDB Entry DOI: 10.7270/Q2NK3D3T
More data for this
Ligand-Target Pair