SCHEMBL11431237

SCHEMBL11431237

Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](OS(=O)(=O)O)[C@H]2OS(=O)(=O)O)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.56
HINT1 P49773 5/20 0.51
NT5E P21589 1/20 0.51
PNP P00491 2/20 0.51
GSK3A P49840 2/20 0.49
RPS6KA3 P51812 2/20 0.49
MAPK14 Q16539 2/20 0.49
TGM2 P21980 1/20 0.48
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
KRAS P01116 2/20 0.46
STING1 Q86WV6 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44

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
SCHEMBL2680046 0.85 HINT1 (0.61) HINT1NT5EPNPGSK3ARPS6KA3
SCHEMBL23343338 0.85 HPGD (0.63) HPGDHINT1NT5EPNPGSK3A
Guanosine SCHEMBL27505899 0.83 HPGD (0.70) HPGDHINT1NT5EPNPGSK3A
SCHEMBL8205186 0.82 HPGD (0.58) HPGDHINT1NT5EPNPGSK3A
SCHEMBL22334153 0.82 HPGD (0.60) HPGDHINT1NT5EPNPGSK3A
SCHEMBL3812199 0.82 HPGD (0.58) HPGDHINT1NT5EPNPGSK3A
SCHEMBL13597930 0.82 HPGD (0.58) HPGDHINT1NT5EPNPGSK3A
SCHEMBL6537060 0.82 HPGD (0.60) HPGDHINT1NT5EPNPGSK3A
SCHEMBL23880677 0.82 HPGD (0.63) HPGDHINT1NT5EPNPGSK3A
SCHEMBL7549552 0.82 HPGD (0.60) HPGDHINT1NT5EPNPGSK3A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4242505-A S-Adenosyl-L-methionine compositions and production thereof YAMASA SHOYU KABUSHIKI KAISHA (JP) 1980-12-30 US claimed
US-4242505-A S-Adenosyl-L-methionine compositions and production thereof YAMASA SHOYU KABUSHIKI KAISHA (JP) 1980-12-30 US disclosed