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Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic Anhydrase II Mutant (F131V)' and Ligand = 'BDBM12022'   
Target
(Institution)
LigandTarget
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 II Mutant (F131V)


(Homo sapiens (human))
BDBM12022
PNG
(3,4,5-trifluoro-SBB | 4-(AMINOSULFONYL)-N-[(3,4,5-...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cc(F)c(F)c(F)c1
Show InChI InChI=1S/C14H11F3N2O3S/c15-11-5-8(6-12(16)13(11)17)7-19-14(20)9-1-3-10(4-2-9)23(18,21)22/h1-6H,7H2,(H,19,20)(H2,18,21,22)
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PC cid
PC sid
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Similars

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PDB
PubMed
n/an/an/a 3.90n/an/an/a7.437



University of Pennsylvania



Assay Description
Inhibitor binding to CA II was determined using a fluorescence competition assay. Displacement of dansylamide and binding of the inhibitor was determ...


J Am Chem Soc 123: 9620-7 (2001)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)