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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 = 'BDBM50205574'   
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))
BDBM50205574
PNG
(CHEMBL3950179)
Show SMILES O=C1CCCC2=C1C(C1=C(CCCC1=O)O2)c1ccc(cc1)-c1nnn[nH]1 |c:5,t:9|
Show InChI InChI=1S/C20H18N4O3/c25-13-3-1-5-15-18(13)17(19-14(26)4-2-6-16(19)27-15)11-7-9-12(10-8-11)20-21-23-24-22-20/h7-10,17H,1-6H2,(H,21,22,23,24)
PDB
MMDB

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Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Dumlupinar University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 7 expressed in Escherichia coli assessed as reduction in CO2 hydration preincubated for 15 mins pr...


Bioorg Med Chem Lett 27: 86-89 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.028
BindingDB Entry DOI: 10.7270/Q25D8TT1
More data for this
Ligand-Target Pair