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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium/hydrogen exchanger 1' and Ligand = 'BDBM50345916'   
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
Sodium/hydrogen exchanger 1


(Rattus norvegicus)
BDBM50345916
PNG
(CHEMBL1783856 | N-(diaminomethylene)-3-(N-methylsu...)
Show SMILES CNS(=O)(=O)c1cc(ccc1CN1CCN(Cc2ccc(OC)c(OC)c2OC)CC1)C(=O)NC(N)=N
Show InChI InChI=1S/C24H34N6O6S/c1-27-37(32,33)20-13-16(23(31)28-24(25)26)5-6-17(20)14-29-9-11-30(12-10-29)15-18-7-8-19(34-2)22(36-4)21(18)35-3/h5-8,13,27H,9-12,14-15H2,1-4H3,(H4,25,26,28,31)
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Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of NHE1-mediated rat platelet swelling


Bioorg Med Chem Lett 19: 3283-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.079
BindingDB Entry DOI: 10.7270/Q2BR8SJ1
More data for this
Ligand-Target Pair