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BDBM50080215 CHEMBL76302::N-{(S)-1-Benzyl-2-oxo-2-[2-(5-pyridin-2-yl-thiophene-2-sulfonylamino)-ethylcarbamoyl]-ethyl}-benzamide

SMILES: O=C(NCCNS(=O)(=O)c1ccc(s1)-c1ccccn1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1

InChI Key: InChIKey=KUHKUEPPTKJUMQ-QHCPKHFHSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50080215   
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
Calpain1


(Homo sapiens (Human))		BDBM50080215
PNG
(CHEMBL76302 | N-{(S)-1-Benzyl-2-oxo-2-[2-(5-pyridi...)
Show SMILES O=C(NCCNS(=O)(=O)c1ccc(s1)-c1ccccn1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1
Show InChI InChI=1S/C28H26N4O5S2/c33-26(23(19-20-9-3-1-4-10-20)32-27(34)21-11-5-2-6-12-21)28(35)30-17-18-31-39(36,37)25-15-14-24(38-25)22-13-7-8-16-29-22/h1-16,23,31H,17-19H2,(H,30,35)(H,32,34)/t23-/m0/s1
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PubMed
 570n/an/an/an/an/an/an/an/a



Cephalon Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human calpain I

Bioorg Med Chem Lett 9: 2371-4 (1999)


BindingDB Entry DOI: 10.7270/Q2BK1BHT
More data for this
Ligand-Target Pair