SCHEMBL25171429

SCHEMBL25171429

Nc1nc2c(ncn2[C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)[nH]1.Nc1nc2c(ncn2[C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)[nH]1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.82
▸ P2RY2 P41231 1/20 0.68
▸ P2RY4 P51582 1/20 0.68
▸ P2RY6 Q15077 1/20 0.68
▸ NT5E P21589 2/20 0.60
▸ TGM2 P21980 1/20 0.56
▸ IMPDH2 P12268 5/20 0.54
▸ TAS1R3 Q7RTX0 2/20 0.54
▸ TAS1R1 Q7RTX1 2/20 0.54
▸ IMPDH1 P20839 1/20 0.54
▸ FUT5 Q11128 1/20 0.54
▸ TYMS P04818 1/20 0.54
▸ KRAS P01116 1/20 0.53

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
SCHEMBL17117812 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL16678590 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL18785118 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL48232 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL1971161 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL2231785 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6NT5E
Water SCHEMBL7247857 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL29258727 0.96 POLB (0.77) POLBP2RY2P2RY4P2RY6NT5E
SCHEMBL30927571 0.96 POLB (0.77) POLBP2RY2P2RY4P2RY6NT5E
Triphosphate SCHEMBL27909453 0.96 POLB (0.82) POLBP2RY2P2RY4P2RY6NT5E

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
WO-2023080663-A1 METABOLITE MARKER FOR DIAGNOSIS OF MYCOBACTERIUM AVIUM COMPLEX INFECTIOUS DISEASE OR FOR PREDICTION OF SEVERITY 연세대학교 산학협력단 2023-05-11 — — WO disclosed
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