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BDBM185702 US9161945, (I)

SMILES: COc1cc(C(C)C)c(Cc2ccc(\C=C\C(C)(C)C(=O)NC(C)(C)C(N)=O)cc2C)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

InChI Key: InChIKey=JQKPCFYQZIKDQK-TUQANRCYSA-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 = 185702   
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


(Homo sapiens (Human))
BDBM185702
PNG
(US9161945, (I))
Show SMILES COc1cc(C(C)C)c(Cc2ccc(\C=C\C(C)(C)C(=O)NC(C)(C)C(N)=O)cc2C)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C34H48N2O8/c1-18(2)23-16-25(43-8)24(30-29(40)28(39)27(38)26(17-37)44-30)15-22(23)14-21-10-9-20(13-19(21)3)11-12-33(4,5)32(42)36-34(6,7)31(35)41/h9-13,15-16,18,26-30,37-40H,14,17H2,1-8H3,(H2,35,41)(H,36,42)/b12-11+/t26-,27-,28+,29-,30+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 554n/an/an/an/a7.437



TAISHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Pretreatment buffer (140 mM choline chloride, 2 mM KCl, 1 mM CaCl2, 1 mM MgCl2, 10 mM HEPES/5 mM Tris, pH 7.4) was added to the stably expressing cel...


US Patent US9161945 (2015)


BindingDB Entry DOI: 10.7270/Q27M06PF
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 1


(Homo sapiens (Human))
BDBM185702
PNG
(US9161945, (I))
Show SMILES COc1cc(C(C)C)c(Cc2ccc(\C=C\C(C)(C)C(=O)NC(C)(C)C(N)=O)cc2C)cc1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C34H48N2O8/c1-18(2)23-16-25(43-8)24(30-29(40)28(39)27(38)26(17-37)44-30)15-22(23)14-21-10-9-20(13-19(21)3)11-12-33(4,5)32(42)36-34(6,7)31(35)41/h9-13,15-16,18,26-30,37-40H,14,17H2,1-8H3,(H2,35,41)(H,36,42)/b12-11+/t26-,27-,28+,29-,30+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 65n/an/an/an/a7.437



TAISHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Pretreatment buffer (140 mM choline chloride, 2 mM KCl, 1 mM CaCl2, 1 mM MgCl2, 10 mM HEPES/5 mM Tris, pH 7.4) was added to the stably expressing cel...


US Patent US9161945 (2015)


BindingDB Entry DOI: 10.7270/Q27M06PF
More data for this
Ligand-Target Pair