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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium/nucleoside cotransporter 2' and Ligand = 'BDBM50172401'   
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/nucleoside cotransporter 2


(Homo sapiens (Human))		BDBM50172401
PNG
(CHEMBL3808405)
Show SMILES CC(C)Oc1cc(ccc1CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)-c1ccccc1 |r|
Show InChI InChI=1S/C26H30N6O5/c1-14(2)36-18-10-16(15-6-4-3-5-7-15)8-9-17(18)11-28-26-31-20-23(27)29-13-30-24(20)32(26)25-22(35)21(34)19(12-33)37-25/h3-10,13-14,19,21-22,25,33-35H,11-12H2,1-2H3,(H,28,31)(H2,27,29,30)/t19-,21-,22-,25-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.30E+3n/an/an/an/an/an/a



Kissei Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human CNT2 expressed in African green monkey COS7 cells assessed as reduction of [14C]-inosine uptake by liquid scintillation counting ...

J Med Chem 59: 3719-31 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01884
BindingDB Entry DOI: 10.7270/Q2ZW1NT8
More data for this
Ligand-Target Pair