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SMILES: Clc1cc(cc(=O)o1)-c1ccccc1

InChI Key: InChIKey=ADZCYGJCIMPFOO-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50025544   
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
Chymotrypsin-C


(Homo sapiens (Human))
BDBM50025544
PNG
(6-Chloro-4-phenyl-pyran-2-one | CHEMBL16485)
Show SMILES Clc1cc(cc(=O)o1)-c1ccccc1
Show InChI InChI=1S/C11H7ClO2/c12-10-6-9(7-11(13)14-10)8-4-2-1-3-5-8/h1-7H
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
3.82E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity towards alpha-chymotrypsin from bovine pancreas.


J Med Chem 29: 1159-63 (1987)


BindingDB Entry DOI: 10.7270/Q27080D6
More data for this
Ligand-Target Pair