SCHEMBL8606010

SCHEMBL8606010

Nc1ncnc2c1ncn2[C@]1([C@H]2CCC[C@H]2O)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC28A1 O00337 2/20 0.53
ADORA3 P0DMS8 5/20 0.51
ADORA2A P29274 3/20 0.51
PI4KA P42356 2/20 0.48
PI4K2B Q8TCG2 2/20 0.48
PI4K2A Q9BTU6 2/20 0.48
PI4KB Q9UBF8 2/20 0.48
DPP4 P27487 1/20 0.48
MEN1 O00255 1/20 0.48
MAP3K7 O43318 1/20 0.48
SLC28A2 O43868 1/20 0.48
GAPDH P04406 1/20 0.48
MAPK1 P28482 1/20 0.48
ADORA2B P29275 1/20 0.48
ADORA1 P30542 1/20 0.48
STAT6 P42226 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
DOT1L Q8TEK3 1/20 0.48
SLC29A1 Q99808 1/20 0.48

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
SCHEMBL8608410 0.98 SLC28A1 (0.53) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL123719 0.90 ADORA3 (0.49) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL120550 0.87 ADORA3 (0.51) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL10689174 0.86 ADORA3 (0.53) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL120561 0.86 ADORA3 (0.50) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL28822391 0.85 ADORA3 (0.48) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL8608416 0.84 ADORA3 (0.47) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL8608777 0.84 ADORA3 (0.50) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL10699083 0.83 ADORA3 (0.48) SLC28A1ADORA3ADORA2API4KAPI4K2B
SCHEMBL2372382 0.83 ADORA2A (0.49) ADORA3ADORA2AADORA1AHCY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0322242-B1 Adenosine derivatives GLAXO GROUP LTD (GB) 1998-04-01 EP claimed
EP-0322242-B1 Adenosine derivatives GLAXO GROUP LTD (GB) 1998-04-01 EP disclosed
EP-0322242-A2 Adenosine derivatives GLAXO GROUP LIMITED (GB) 1989-06-28 EP disclosed