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Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-chymotrypsin' and Ligand = 'BDBM50058995'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-chymotrypsin


(Bos taurus (bovine))
BDBM50058995
PNG
(3-[4-(4-Methyl-piperazine-1-carbonyl)-benzenesulfo...)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)S(=O)(=O)N1C(=O)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C21H22N4O5S/c1-22-11-13-23(14-12-22)20(27)16-7-9-18(10-8-16)31(29,30)25-19(26)15-24(21(25)28)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 6.40E+3n/an/an/an/an/an/a



Suntory Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreas alpha-chymotrypsin in vitro


J Med Chem 40: 2156-63 (1997)

More data for this
Ligand-Target Pair