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Gene Set: D4 : TTD - Pregnenolone

Collection D4 : TTD
Chemical Name Pregnenolone ( From PubChem : PREGNENOLONE )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotApprovedNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
316.478 g/mol 1 2 4.5153 True
Structure
InChI InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey ORNBQBCIOKFOEO-QGVNFLHTSA-N
Links

Gene (5 / 13)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDInhibitorCYP17A1Successful target
PubChem Ratio Potency (uM)uM3.739AR-GI(Protien) :
PubChem Potency-Replicate_1uM0.596ESR1-GI(Protien) :
PubChem Potency-Replicate_1uM0.952ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM3.008ESR1-GI(Protien) :
PubChem Potency-Replicate_1uM3.463ESR1-GI(Protien) :
PubChem Potency-Replicate_1uM5.443ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM7.180ESR1-GI(Protien) :
PubChem Potency-Replicate_1uM12.185NFE2L2-GI(Protien) :
PubChem Ratio Potency (uM)uM12.185NFE2L2-GI(Protien) :
PubChem Potency-Replicate_1uM1.693NR3C1-GI(Protien) :
PubChem Potency-Replicate_1uM4.359NR3C1-GI(Protien) :
PubChem NoneuMNR3C1-GI(Protien) :
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