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BDBM50036069 2-(8-Hydroxy-1-oxo-3-phenyl-1,9-dihydro-beta-carbolin-2-yl)-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)-acetamide::CHEMBL367300

SMILES: CC(C)C(NC(=O)Cn1c(O)c2nc3c(O)cccc3c2cc1-c1ccccc1)C(=O)C(F)(F)F

InChI Key: InChIKey=QBDNLKBBUVVEAO-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50036069   
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))		BDBM50036069
PNG
(2-(8-Hydroxy-1-oxo-3-phenyl-1,9-dihydro-beta-carbo...)
Show SMILES CC(C)C(NC(=O)Cn1c(O)c2nc3c(O)cccc3c2cc1-c1ccccc1)C(=O)C(F)(F)F
Show InChI InChI=1S/C25H22F3N3O4/c1-13(2)20(23(34)25(26,27)28)29-19(33)12-31-17(14-7-4-3-5-8-14)11-16-15-9-6-10-18(32)21(15)30-22(16)24(31)35/h3-11,13,20,32,35H,12H2,1-2H3,(H,29,33)
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PubMed
 6.70n/an/an/an/an/an/an/an/a



ZENECA Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human leukocyte elastase (HLE) mediated hydrolysis of the synthetic substrate MeOSuc-Ala-Ala-Pro-Val-pNA

J Med Chem 38: 86-97 (1995)


BindingDB Entry DOI: 10.7270/Q2TD9WDR
More data for this
Ligand-Target Pair