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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic Anhydrase XIII' and Ligand = 'BDBM50303490'   
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 XIII


(Mus musculus (mouse))
BDBM50303490
PNG
(6-(hydroxymethyl)-2-oxo-2H-chromene-3-carboxylic a...)
Show SMILES OCc1ccc2oc(=O)c(cc2c1)C(O)=O
Show InChI InChI=1S/C11H8O5/c12-5-6-1-2-9-7(3-6)4-8(10(13)14)11(15)16-9/h1-4,12H,5H2,(H,13,14)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
3.10E+3n/an/an/an/an/an/an/an/a



Universita degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of mouse carbonic anhydrase 13 by stopped flow CO2 hydration assay


J Med Chem 53: 335-44 (2010)


Article DOI: 10.1021/jm901287j
BindingDB Entry DOI: 10.7270/Q2MS3TP5
More data for this
Ligand-Target Pair