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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium/hydrogen exchanger 3' and Ligand = 'BDBM50471798'   
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 3


(Oryctolagus cuniculus)		BDBM50471798
PNG
(CHEMBL122238)
Show SMILES [#6]C1([#6])[#6]C([#6])([#6])S(=O)(=O)c2cc(ccc12)-[#6](=O)\[#7]=[#6](\[#7])-[#7]
Show InChI InChI=1S/C15H21N3O3S/c1-14(2)8-15(3,4)22(20,21)11-7-9(5-6-10(11)14)12(19)18-13(16)17/h5-7H,8H2,1-4H3,(H4,16,17,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 360n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Sodium/hydrogen exchanger antiport activity was measured using [22]Na+ uptake inhibition assay in acidified rabbit erythrocytes

J Med Chem 41: 3736-47 (1998)


Article DOI: 10.1021/jm981031w
BindingDB Entry DOI: 10.7270/Q2BK1G33
More data for this
Ligand-Target Pair