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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM246511'   
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
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246511
PNG
(1-(3-Methoxyphenyl)-3-(4-(1,3,7,7-tetramethyl-5-ox...)
Show SMILES COc1cccc(NC(=S)Nc2ccc(cc2)C2N(C)C(=O)N(C)C3=C2C(=O)CC(C)(C)C3)c1 |c:25|
Show InChI InChI=1S/C26H30N4O3S/c1-26(2)14-20-22(21(31)15-26)23(30(4)25(32)29(20)3)16-9-11-17(12-10-16)27-24(34)28-18-7-6-8-19(13-18)33-5/h6-13,23H,14-15H2,1-5H3,(H2,27,28,34)
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Article
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n/an/a 1.70E+5n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of sulphanilamide, different concentrationsof these compounds were added to the enzyme. Activity percentage values of CA f...

J Enzyme Inhib Med Chem 29: 18-22 (2014)


Article DOI: 10.3109/14756366.2012.746972
BindingDB Entry DOI: 10.7270/Q28S4NVM
More data for this
Ligand-Target Pair