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SMILES: O[C@H](C[C@@H](Cc1ccc(cc1)-c1cccc(Cl)c1)NC(=O)c1cc(=O)n([nH]1)-c1ccccc1)C(O)=O

InChI Key: InChIKey=JMMTXWAWXYXATG-ZJSXRUAMSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 459399   
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
Neprilysin


(Homo sapiens (Human))		BDBM459399
PNG
(US10759813, Example 18-41)
Show SMILES O[C@H](C[C@@H](Cc1ccc(cc1)-c1cccc(Cl)c1)NC(=O)c1cc(=O)n([nH]1)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C27H24ClN3O5/c28-20-6-4-5-19(14-20)18-11-9-17(10-12-18)13-21(15-24(32)27(35)36)29-26(34)23-16-25(33)31(30-23)22-7-2-1-3-8-22/h1-12,14,16,21,24,30,32H,13,15H2,(H,29,34)(H,35,36)/t21-,24-/m1/s1
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KEGG

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US Patent
<1n/an/an/an/an/an/an/an/a



Theravance Biopharma R&D IP, LLC

US Patent


Assay Description
The assays were performed in 384-well white opaque plates at 37° C. using the fluorogenic peptide substrates at a concentration of 10 μM in Assa...

US Patent US10759813 (2020)


BindingDB Entry DOI: 10.7270/Q2XW4NW0
More data for this
Ligand-Target Pair