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SMILES: Brc1ccc(\C=N\NC(=O)N\N=C\c2ccc(Br)cc2)cc1

InChI Key: InChIKey=HOVJSLVQBXFGGS-VNIJRHKQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 222431   
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


(Bos taurus)
BDBM222431
PNG
(N'',N'''-Bis[(E)-(4-bromophenyl)methylidene]ca...)
Show SMILES Brc1ccc(\C=N\NC(=O)N\N=C\c2ccc(Br)cc2)cc1
Show InChI InChI=1S/C15H12Br2N4O/c16-13-5-1-11(2-6-13)9-18-20-15(22)21-19-10-12-3-7-14(17)8-4-12/h1-10H,(H2,20,21,22)/b18-9+,19-10+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
Article
PubMed
2.52E+3n/an/an/an/an/an/a7.4n/a



University of Karachi; Government College University Faisalabad



Assay Description
Kinetic studies were performed by using different concentration of inhibitors over different concentrations of substrate (4-NPA) such as 0.175, 0.35,...


Bioorg Chem 72: 89-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.03.014
BindingDB Entry DOI: 10.7270/Q2125RHB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Bos taurus)
BDBM222431
PNG
(N'',N'''-Bis[(E)-(4-bromophenyl)methylidene]ca...)
Show SMILES Brc1ccc(\C=N\NC(=O)N\N=C\c2ccc(Br)cc2)cc1
Show InChI InChI=1S/C15H12Br2N4O/c16-13-5-1-11(2-6-13)9-18-20-15(22)21-19-10-12-3-7-14(17)8-4-12/h1-10H,(H2,20,21,22)/b18-9+,19-10+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.32E+3n/an/an/an/a7.425



University of Karachi; Government College University Faisalabad



Assay Description
In this assay, 4-nitrophenyl acetate (4-NPA), a colorless compound, was hydrolyzed to 4-nitrophenol and CO2. The reaction was followed by measuring t...


Bioorg Chem 72: 89-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.03.014
BindingDB Entry DOI: 10.7270/Q2125RHB
More data for this
Ligand-Target Pair