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BDBM232251 US9345742, 9

SMILES: CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC

InChI Key: InChIKey=FTMWUGWXNGDDBR-XAAQGLMKSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 232251   
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
Cathepsin D


(Homo sapiens (Human))		BDBM232251
PNG
(US9345742, 9)
Show SMILES CC[C@H](C)[C@H](NC(=O)C[C@H](N)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
Show InChI InChI=1S/C37H56N6O8S/c1-9-24(6)34(36(47)42-33(23(4)5)37(48)51-7)41-31(45)21-28(38)29(19-25-14-11-10-12-15-25)39-35(46)32(22(2)3)40-30(44)20-26-16-13-17-27(18-26)43-52(8,49)50/h10-18,22-24,28-29,32-34,43H,9,19-21,38H2,1-8H3,(H,39,46)(H,40,44)(H,41,45)(H,42,47)/t24-,28-,29-,32-,33-,34-/m0/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 81n/an/an/an/a5.525



MERCK PATENT GMBH

US Patent


Assay Description
In order to identify modulators of cathepsin D activity, a continuous enzymatic test was carried out with a synthetic peptide which carries a fluores...

US Patent US9345742 (2016)


BindingDB Entry DOI: 10.7270/Q25Q4TZD
More data for this
Ligand-Target Pair