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BDBM176529 US9688710, 92 (2S,3R,4R,5S,6R)-2-(3-(4-(4-aminobutyl)benzyl)-4-methylphenyl)-6-(methylthio)tetrahydro-2H-pyran-3,4,5-triol

SMILES: CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCCN)cc2)c1

InChI Key: InChIKey=ZVMRCEYPORQZBP-IKBCPSKINA-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 = 176529   
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/glucose cotransporter 2 (SGLT2)


(Homo sapiens (Human))
BDBM176529
PNG
(US9688710, 92 (2S,3R,4R,5S,6R)-2-(3-(4-(4-aminobut...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCCN)cc2)c1
Show InChI InChI=1/C24H33NO4S/c1-15-6-11-18(23-21(27)20(26)22(28)24(29-23)30-2)14-19(15)13-17-9-7-16(8-10-17)5-3-4-12-25/h6-11,14,20-24,26-28H,3-5,12-13,25H2,1-2H3/t20-,21-,22+,23+,24-/s2
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/a7.3n/a



Lexicon Pharmaceuticals, Inc.

US Patent


Assay Description
Human sodium/glucose co-transporter type 2 (SGLT2; accession number P31639; GI:400337) was cloned into pIRESpuro2 vector for mammalian expression (co...


US Patent US9688710 (2017)


BindingDB Entry DOI: 10.7270/Q2154F7P
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1 (SGLT1)


(Homo sapiens (Human))
BDBM176529
PNG
(US9688710, 92 (2S,3R,4R,5S,6R)-2-(3-(4-(4-aminobut...)
Show SMILES CS[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(C)c(Cc2ccc(CCCCN)cc2)c1
Show InChI InChI=1/C24H33NO4S/c1-15-6-11-18(23-21(27)20(26)22(28)24(29-23)30-2)14-19(15)13-17-9-7-16(8-10-17)5-3-4-12-25/h6-11,14,20-24,26-28H,3-5,12-13,25H2,1-2H3/t20-,21-,22+,23+,24-/s2
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/a7.3n/a



Lexicon Pharmaceuticals, Inc.

US Patent


Assay Description
Human sodium/glucose co-transporter type 1 (SGLT1; accession number NP_000334; GI: 4507031) was cloned into pIRESpuro2 vector for mammalian expressio...


US Patent US9688710 (2017)


BindingDB Entry DOI: 10.7270/Q2154F7P
More data for this
Ligand-Target Pair