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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 = 'BDBM50345912'   
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)
BDBM50345912
PNG
(CHEMBL1783853 | N-(diaminomethylene)-4-nitro-3-((4...)
Show SMILES COc1ccc(CN2CCN(Cc3cc(ccc3[N+]([O-])=O)C(=O)NC(N)=N)CC2)c(OC)c1OC
Show InChI InChI=1S/C23H30N6O6/c1-33-19-7-5-16(20(34-2)21(19)35-3)13-27-8-10-28(11-9-27)14-17-12-15(22(30)26-23(24)25)4-6-18(17)29(31)32/h4-7,12H,8-11,13-14H2,1-3H3,(H4,24,25,26,30)
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Similars

Article
PubMed
n/an/a 14.2n/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