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Gene Set: D4 : TTD - GR55562

Collection D4 : TTD
Chemical Name GR55562 ( From PubChem : GR 55562 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
411.924 g/mol 3 5 5.0757 False(3/4)
Structure
InChI InChI=1S/C23H25N3O2.ClH/c1-26(2)15-3-4-19-16-20(7-10-22(19)27)23(28)25-21-8-5-17(6-9-21)18-11-13-24-14-12-18;/h5-14,16,27H,3-4,15H2,1-2H3,(H,25,28);1H
InChIKey NUDSRNNZTVHCKY-UHFFFAOYSA-N
Links

Gene (4 / 9)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDAntagonistHTR1BSuccessful target
PubChem NoneuMCYP1A2-GI(Protien) :
PubChem PotencyuM5.012CYP2D6-GI(Protien) :
PubChem NoneuMCYP2D6-GI(Protien) :
PubChem PotencyuM25.119EHMT2-GI(Protien) :
PubChem NoneuMHTR1BGI(Protien) :
ChEMBLAC50nM5011.870CYP2D6
-Target : CHEMBL289
ChEMBLPotencynM5011.900CYP2D6
-Target : CHEMBL289
ChEMBLPotencynM25118.900EHMT2
-Target : CHEMBL6032
Download gene sets gmt, text, Detailed text
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