SCHEMBL7033904

SCHEMBL7033904

Nc1ncnc2c1ncn2[C@]1(C2OCC(O)C(O)C2O)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.51
ADORA2A P29274 3/20 0.51
SLC28A1 O00337 2/20 0.48
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
SCHEMBL27456462 1.00 ADORA3 (0.51) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL5698887 1.00 ADORA3 (0.51) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL6551165 1.00 ADORA3 (0.51) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL30516580 0.89 ADORA3 (0.38) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL6265406 0.87 ADORA3 (0.59) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL6266464 0.87 ADORA3 (0.59) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL38659369 0.86 ADORA3 (0.58) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL30475513 0.86 ADORA3 (0.58) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL30999514 0.85 P2RY1 (0.54) ADORA1SMN1; SMN2ALDH1A1
SCHEMBL10689174 0.84 ADORA3 (0.53) ADORA3ADORA2ASLC28A1PI4KAPI4K2B

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-1019423-B1 METHOD FOR PRODUCING A PENTOPYRANOSYL NUCLEOSIDE NANOGEN RECOGNOMICS GMBH (DE) 2003-02-26 EP claimed