SCHEMBL9851727

SCHEMBL9851727

C[Si](C)(C)OC[C@@H]1C[C@@H](O[Si](C)(C)C)[C@H](n2cnc3c(O)ncnc32)O1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.37
GAA P10253 1/20 0.36
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
BCHE P06276 1/20 0.35
ADORA1 P30542 1/20 0.35
AHCY P23526 1/20 0.35

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
SCHEMBL9851733 0.90 SLC29A1 (0.41) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL9851739 0.90 SLC29A1 (0.41) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL9851785 0.87 BCHE (0.45) ADORA3BCHEAHCY
SCHEMBL9851797 0.87 BCHE (0.45) ADORA3BCHEAHCY
SCHEMBL9851908 0.85 ADORA1 (0.35) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL9851844 0.81 ADORA3 (0.35) ADORA3GAAADORA1AHCY
SCHEMBL9851766 0.80 SLC29A1 (0.39) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL9851773 0.80 SLC29A1 (0.39) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL9851720 0.80 ADORA1 (0.36) ADORA3GAAPI4KAPI4K2BPI4K2A
SCHEMBL7069026 0.78 PRKAB2 (0.46) ADORA3ADORA1AHCY

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
EP-0450102-A1 NUCLEOSIDE DERIVATIVE Yamasa Shoyu Kabushiki Kaisha (JP) 1991-10-09 EP disclosed