SCHEMBL13638721

SCHEMBL13638721

[N-]=[N+]=NC1C(O)[C@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H]1COP(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.65
▸ TGM2 P21980 1/20 0.61
▸ IMPDH2 P12268 7/20 0.60
▸ IMPDH1 P20839 2/20 0.60
▸ TAS1R3 Q7RTX0 2/20 0.57
▸ TAS1R1 Q7RTX1 2/20 0.57
▸ KRAS P01116 7/20 0.56
▸ FUT5 Q11128 1/20 0.55
▸ HINT1 P49773 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30888422 1.00 NT5E (0.65) NT5ETGM2IMPDH2IMPDH1TAS1R3
SCHEMBL29258529 0.93 NT5E (0.65) NT5ETGM2IMPDH2IMPDH1TAS1R3
SCHEMBL16840866 0.88 HPGD (0.56) NT5ETGM2HINT1
E626 SCHEMBL165027 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL18785103 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL20277596 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL18763818 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL20677331 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL21163348 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3
E626 SCHEMBL5854 0.88 NT5E (0.83) NT5ETGM2IMPDH2IMPDH1TAS1R3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304529-B2 Dinucleotide MRNA cap analogs Life Technologies Corporation (US) 2012-11-06 — — US disclosed
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