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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 = 'BDBM50209858'   
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))
BDBM50209858
PNG
(CHEMBL3884577)
Show SMILES Cc1ccc(cc1)-c1cn2nc(sc2n1)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H14N4O2S2/c1-11-2-4-12(5-3-11)15-10-21-17(19-15)24-16(20-21)13-6-8-14(9-7-13)25(18,22)23/h2-10H,1H3,(H2,18,22,23)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
240n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human erythrocyte cytosolic carbonic anhydrase 2 by stopped-flow CO2 hydration assay


Bioorg Med Chem 25: 1286-1293 (2017)


Article DOI: 10.1016/j.bmc.2016.12.047
BindingDB Entry DOI: 10.7270/Q2222WSR
More data for this
Ligand-Target Pair