Substrate
/
Generation 1
/
Generation 2
XenoSite
Anagrelide
O=C1CN2Cc3c(ccc(Cl)c3Cl)N=C2N1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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O=C1Cn2cc3c(=O)c(Cl)ccc-3nc2N1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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O=C1CN2C=C3C(=O)C(Cl)=CC=C3N3OC23N1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
protein
Probability 0.27
0.27
dna
Probability 0.19
0.19
glutathionation
Probability 0.15
0.15
protein
Probability 0.12
0.12
protein
Probability 0.11
0.11
Showing 5 of 12 metabolites
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