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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 7' and Ligand = 'BDBM50408526'   
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 7


(Homo sapiens (Human))
BDBM50408526
PNG
(CHEMBL4163381)
Show SMILES [#6]-[#6](=O)-[#8]-c1ccccc1-[#6](=O)-[#7]-c1ccc([Se;v2][#6]-c2ccc(cc2)S([#7])(=O)=O)cc1
Show InChI InChI=1S/C22H20N2O5SSe/c1-15(25)29-21-5-3-2-4-20(21)22(26)24-17-8-12-19(13-9-17)31-14-16-6-10-18(11-7-16)30(23,27)28/h2-13H,14H2,1H3,(H,24,26)(H2,23,27,28)
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MMDB

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Similars

Article
PubMed
0.930n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 7 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 154: 210-219 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.026
BindingDB Entry DOI: 10.7270/Q2VX0K2M
More data for this
Ligand-Target Pair