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BDBM50302605 (2S,3R,4R,5S)-2-(4-Chloro-3-(4-ethoxybenzyl)phenyl)-6-methoxy-2-methyltetrahydro-2Hpyran-3,4,5-triol::CHEMBL583016

SMILES: CCOc1ccc(Cc2cc(ccc2Cl)[C@]2(C)OC(OC)[C@@H](O)[C@H](O)[C@H]2O)cc1

InChI Key: InChIKey=GLURLYOHPZNJHO-OTGIXZHXSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50302605   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
sodium-dependent glucose cotransporter 2 (SGLT2)


(Mus musculus (Mouse))
BDBM50302605
PNG
((2S,3R,4R,5S)-2-(4-Chloro-3-(4-ethoxybenzyl)phenyl...)
Show SMILES CCOc1ccc(Cc2cc(ccc2Cl)[C@]2(C)OC(OC)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
Show InChI InChI=1S/C22H27ClO6/c1-4-28-16-8-5-13(6-9-16)11-14-12-15(7-10-17(14)23)22(2)20(26)18(24)19(25)21(27-3)29-22/h5-10,12,18-21,24-26H,4,11H2,1-3H3/t18-,19-,20+,21?,22-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 220n/an/an/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of mouse SGLT2-mediated [14C]alpha-methylglucopyranoside uptake by cell based assay


J Med Chem 52: 6201-4 (2009)


Article DOI: 10.1021/jm900951n
BindingDB Entry DOI: 10.7270/Q2F76DH1
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2 (SGLT2)


(Homo sapiens (Human))
BDBM50302605
PNG
((2S,3R,4R,5S)-2-(4-Chloro-3-(4-ethoxybenzyl)phenyl...)
Show SMILES CCOc1ccc(Cc2cc(ccc2Cl)[C@]2(C)OC(OC)[C@@H](O)[C@H](O)[C@H]2O)cc1 |r|
Show InChI InChI=1S/C22H27ClO6/c1-4-28-16-8-5-13(6-9-16)11-14-12-15(7-10-17(14)23)22(2)20(26)18(24)19(25)21(27-3)29-22/h5-10,12,18-21,24-26H,4,11H2,1-3H3/t18-,19-,20+,21?,22-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 590n/an/an/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of human SGLT2 expressed in HEK293 cells assessed as inhibition of [14C]alpha-methylglucopyranoside uptake


J Med Chem 52: 6201-4 (2009)


Article DOI: 10.1021/jm900951n
BindingDB Entry DOI: 10.7270/Q2F76DH1
More data for this
Ligand-Target Pair