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Gene Set: D4 : TTD - Epalrestat

Collection D4 : TTD
Chemical Name Epalrestat ( From PubChem : EPALRESTAT )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotApprovedNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
319.399 g/mol 1 6 2.8566 True
Structure
InChI InChI=1S/C15H13NO3S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(19)16(9-13(17)18)15(20)21-12/h2-8H,9H2,1H3,(H,17,18)/b10-7+,12-8-
InChIKey CHNUOJQWGUIOLD-NFZZJPOKSA-N
Links

Gene (4 / 10)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDInhibitorAKR1B1Successful target
TTDDrug(s)AKR1B1Successful target
PubChem PotencyuM7.943MAPT-GI(Protien) :
PubChem IC50uM6.478SLC5A7-GI(Protien) :
PubChem IC50uM9.449SLC5A7-GI(Protien) :
PubChem NoneuMSLC5A7-GI(Protien) :
PubChem NoneuMSLC5A7-GI(Protien) :
PubChem NoneuMSLC5A7-GI(Protien) :
PubChem PotencyuM44.668VDR-GI(Protien) :
ChEMBLPotencynM7943.300MAPT
-Target : CHEMBL1293224
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