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Gene Set: D4 : TTD - Ro-04-6790

Collection D4 : TTD
Chemical Name Ro-04-6790 ( From PubChem : RO 04-6790 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
308.359 g/mol 4 8 2.824 True
Structure
InChI InChI=1S/C12H16N6O2S/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18)
InChIKey JELFWSXQTXRMAJ-UHFFFAOYSA-N
Links

Gene (3 / 11)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDInhibitorHTR6Clinical trial target
PubChem PotencyuM1.995CYP2C9-GI(Protien) :
PubChem NoneuMCYP2C9-GI(Protien) :
PubChem PotencyuM0.794CYP3A4-GI(Protien) :
PubChem NoneuMCYP3A4-GI(Protien) :
PubChem NoneuMHTR6GI(Protien) :
PubChem NoneuMHTR6GI(Protien) :
ChEMBLPotencynM1995.300CYP2C9
-Target : CHEMBL3397
ChEMBLAC50nM1995.260CYP2C9
-Target : CHEMBL3397
ChEMBLAC50nM794.330CYP3A4
-Target : CHEMBL340
ChEMBLPotencynM794.300CYP3A4
-Target : CHEMBL340
Download gene sets gmt, text, Detailed text
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