SCHEMBL8094883

SCHEMBL8094883

Nc1ncnc2c1ncn2C1(O)CC[C@@H](CO)O1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.50
ADORA3 P0DMS8 3/20 0.50
SLC28A1 O00337 2/20 0.50
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
GMPS P49915 1/20 0.47
PI4K2A Q9BTU6 5/20 0.47
PI4KA P42356 4/20 0.47
PI4K2B Q8TCG2 4/20 0.47
PI4KB Q9UBF8 4/20 0.47
AHCY P23526 3/20 0.45
ADORA2B P29275 3/20 0.45
ADORA1 P30542 2/20 0.44
ADA P00813 1/20 0.44
DPP4 P27487 1/20 0.42
MEN1 O00255 1/20 0.42
MAP3K7 O43318 1/20 0.42
SLC28A2 O43868 1/20 0.42
GAPDH P04406 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL8108646 0.87 ADORA2A (0.36) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL10427714 0.86 ADORA2A (0.50) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL5180860 0.85 ADORA2A (0.49) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL4745239 0.85 PI4K2A (0.52) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL9446941 0.78 ADORA2A (0.43) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL9956204 0.78 SLC28A1 (0.57) ADORA2AADORA3SLC28A1GMPSPI4K2A
SCHEMBL2335292 0.78 SLC28A1 (0.57) ADORA2AADORA3SLC28A1GMPSPI4K2A
SCHEMBL30382315 0.78 ADORA2A (0.52) ADORA2AADORA3SLC28A1PRMT5WDR77
SCHEMBL8104279 0.77 PNP (0.47) ADORA3MEN1KMT2ASMN1; SMN2
SCHEMBL646291 0.76 ADORA2A (0.56) ADORA2AADORA3SLC28A1PRMT5WDR77

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
US-6040297-A A THERAPEUTIC AGENTS TREATING TUMORS AND RETROVIRAL INFECTIONS INCLUDING HIV INFECTIONS BIOSEARCH ITALIA, S.P.A. (IT) 2000-03-21 US disclosed