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SMILES: OC(=O)c1cccc(\C=N\Cc2ccccc2)c1

InChI Key: InChIKey=QCMWNUBKRQECTC-LFIBNONCSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50294027   
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
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50294027
PNG
(3-((benzylimino)methyl)benzoic acid | CHEMBL561295)
Show SMILES OC(=O)c1cccc(\C=N\Cc2ccccc2)c1
Show InChI InChI=1S/C15H13NO2/c17-15(18)14-8-4-7-13(9-14)11-16-10-12-5-2-1-3-6-12/h1-9,11H,10H2,(H,17,18)/b16-11+
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>1.00E+5n/an/an/an/an/an/an/an/a



ENSCM/UMII/UMR-CNRS 5635

Curated by ChEMBL


Assay Description
Inhibition of human erythrocytes carbonic anhydrase 2 by CO2 hydration assay


J Med Chem 52: 4853-9 (2009)


Article DOI: 10.1021/jm900449v
BindingDB Entry DOI: 10.7270/Q26M36VH
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50294027
PNG
(3-((benzylimino)methyl)benzoic acid | CHEMBL561295)
Show SMILES OC(=O)c1cccc(\C=N\Cc2ccccc2)c1
Show InChI InChI=1S/C15H13NO2/c17-15(18)14-8-4-7-13(9-14)11-16-10-12-5-2-1-3-6-12/h1-9,11H,10H2,(H,17,18)/b16-11+
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



ENSCM/UMII/UMR-CNRS 5635

Curated by ChEMBL


Assay Description
Inhibition of human erythrocytes carbonic anhydrase 1 by CO2 hydration assay


J Med Chem 52: 4853-9 (2009)


Article DOI: 10.1021/jm900449v
BindingDB Entry DOI: 10.7270/Q26M36VH
More data for this
Ligand-Target Pair