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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 1' and Ligand = 'BDBM50051026'   
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 1


(Homo sapiens (Human))
BDBM50051026
PNG
(CHEMBL3309357)
Show SMILES CCOc1nonc1S(N)(=O)=O
Show InChI InChI=1S/C4H7N3O4S/c1-2-10-3-4(7-11-6-3)12(5,8)9/h2H2,1H3,(H2,5,8,9)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
12n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Torino

Curated by ChEMBL


Assay Description
Inhibition of human CA1 by CO2 hydration activity based stopped flow assay


Bioorg Med Chem 22: 3913-21 (2014)


Article DOI: 10.1016/j.bmc.2014.06.016
BindingDB Entry DOI: 10.7270/Q2Q241WD
More data for this
Ligand-Target Pair