Perspectives avancées

Nous fournissons des analyses plus avancées sur les interactions d'une molécule avec le métabolisme humain, les sites de liaison, etc.

Interaction de cette molécule avec le métabolisme

Nous utilisons un modèle d'apprentissage en profondeur pour prédire les interactions de cette molécule avec le métabolisme. Consultez la source pour comprendre la méthodologie.

Réactions qui métabolisent cette molécule
Aromatic OH-glucuronidation BTMR0166
Enzymes: 2.4.1.17
Reagents

Metabolite: InChI=1S/C30H40...

N-Glucuronidation of tertiary aliphatic amine BTMR0244
Enzymes: 2.4.1.17
Reagents

Metabolite: InChI=1S/C30H40...

GSH-conjugation of organohalide BTMR0224
Enzymes: 2.5.1.18
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Metabolite: InChI=1S/C34H48...

Sulfonation of phenolic compound BTMR1376
Enzymes: 2.8.2.1
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Metabolite: InChI=1S/C24H32...

Methylation of phenolic compound BTMR1377
Enzymes: 2.1.1.25
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Metabolite: InChI=1S/C25H34...

Hydroxylation of alicyclic secondary carbon BTMR1068
Reagents

Metabolite: InChI=1S/C24H32...

Hydroxylation of alicyclic secondary carbon BTMR1068
Reagents

Metabolite: InChI=1S/C24H32...

N-Oxidation of alicyclic tertiary amine BTMR1099
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Metabolite: InChI=1S/C24H32...

N-Dealkylation of alicyclic tertiary amine BTMR1144
N-Dealkylation of alicyclic tertiary amine BTMR1144
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Metabolite: InChI=1S/C20H26...

N-Oxidation of aliphatic tertiary amine BTMR1100
Enzymes: CYP1A2 CYP2D6 CYP3A4
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Metabolite: InChI=1S/C24H32...

N-Oxidation of aliphatic tertiary amine BTMR1100
Enzymes: CYP1A2 CYP2D6 CYP3A4
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Metabolite: InChI=1S/C24H32...

Hydroxylation of heteroalicyclic secondary carbon BTMR1070
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Metabolite: InChI=1S/C24H32...

Hydroxylation of heteroalicyclic secondary carbon BTMR1071
Enzymes: CYP1A2
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Metabolite: InChI=1S/C24H32...

Hydroxylation of heteroalicyclic secondary carbon BTMR1071
Enzymes: CYP1A2
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Metabolite: InChI=1S/C24H32...

N-Dealkylation of acyclic tertiary amine BTMR1142
N-Dealkylation of acyclic tertiary amine BTMR1142
N-Dealkylation of acyclic tertiary amine BTMR1142
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Metabolite: InChI=1S/C22H29...

N-Dealkylation of acyclic tertiary amine BTMR1142
Aliphatic hydroxylation of carbon alpha to secondary or tertiary alkyl-N BTMR1081
Reagents

Metabolite: InChI=1S/C24H32...

Aliphatic hydroxylation of carbon alpha to secondary or tertiary alkyl-N BTMR1081
Reagents

Metabolite: InChI=1S/C24H32...

Aliphatic hydroxylation of carbon alpha to secondary or tertiary alkyl-N BTMR1081
Reagents

Metabolite: InChI=1S/C24H32...

Aliphatic hydroxylation of carbon alpha to secondary or tertiary alkyl-N BTMR1081
Reagents

Metabolite: InChI=1S/C24H32...

Aliphatic hydroxylation of carbon alpha to secondary or tertiary alkyl-N BTMR1081
Reagents

Metabolite: InChI=1S/C24H32...

Hydroxylation of alicyclic secondary carbon BTMR1065
Enzymes: CYP2B6
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Metabolite: InChI=1S/C24H32...

Hydroxylation of alicyclic secondary carbon BTMR1065
Enzymes: CYP2B6
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Metabolite: InChI=1S/C24H32...

Hydroxylation of carbon adjacent to halogen BTMR1079
Enzymes: CYP2E1
Reagents

Metabolite: InChI=1S/C24H32...