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SCHEMBL28275952

SCHEMBL28275952

Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(OP(=O)(O)OP(=O)(O)O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.75
▸ TGM2 P21980 1/20 0.75
▸ KRAS P01116 7/20 0.68
▸ FUT5 Q11128 1/20 0.67
▸ IMPDH2 P12268 6/20 0.64
▸ IMPDH1 P20839 2/20 0.64
▸ P2RY2 P41231 1/20 0.63
▸ P2RY4 P51582 1/20 0.63
▸ P2RY6 Q15077 1/20 0.63
▸ HINT1 P49773 1/20 0.62
▸ P2RX3 P56373 1/20 0.62
▸ TAS1R3 Q7RTX0 1/20 0.61
▸ TAS1R1 Q7RTX1 1/20 0.61

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
SCHEMBL27819299 0.99 NT5E (0.74) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL28222628 0.99 NT5E (0.74) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL574773 0.99 NT5E (0.74) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL4366555 0.98 NT5E (0.73) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL28597191 0.98 NT5E (0.73) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL8501729 0.97 NT5E (0.74) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL27688115 0.96 NT5E (0.77) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL5994438 0.96 NT5E (0.72) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL15747222 0.95 NT5E (0.71) NT5ETGM2KRASFUT5IMPDH2
SCHEMBL20850061 0.95 NT5E (0.71) NT5ETGM2KRASFUT5IMPDH2

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
CN-104169438-B Asymmetric hairpin target capture oligomers 简·探针公司 2019-02-26 — — CN disclosed