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Gene Set: D4 : TTD - ALPHA-NAPHTHOFLAVONE


Collection D4 : TTD
Chemical Name ALPHA-NAPHTHOFLAVONE ( From PubChem : 7,8-BENZOFLAVONE )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
272.297 g/mol 0 2 4.6132 True
Structure
InChI InChI=1S/C19H12O2/c20-17-12-18(14-7-2-1-3-8-14)21-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12H
InChIKey VFMMPHCGEFXGIP-UHFFFAOYSA-N
Links

Gene (10 / 15)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorCYP19A1Successful target
TTDInhibitorPRKDCResearch target
PubChem NoneuMCYP1A2-GI(Protien) :
PubChem PotencyuM1.995CYP2C19-GI(Protien) :
PubChem PotencyuM12.589CYP3A4-GI(Protien) :
PubChem PotencyuM31.623MAPK1-GI(Protien) :
PubChem PotencyuM31.623TP53-GI(Protien) :
PubChem PotencyuM31.623TSHR-GI(Protien) :
ChEMBLInhibition-CYP1B1
-Target : CHEMBL4878
ChEMBLPotencynM1995.300CYP2C19
-Target : CHEMBL3622
ChEMBLPotencynM12589.300CYP3A4
-Target : CHEMBL340
ChEMBLPotencynM31622.800HSD17B10
-Target : CHEMBL4159
ChEMBLPotencynM31622.800MAPK1
-Target : CHEMBL4040
ChEMBLPotencynM31622.800TP53
-Target : CHEMBL4096
ChEMBLPotencynM31622.800TSHR
-Target : CHEMBL1963
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