SCHEMBL14134335

SCHEMBL14134335

Nc1ccnc2c1ncn2[C@@H]1O[C@H](/C=C/P(=O)(O)O)[C@@H](CO)[C@H]1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.52
▸ ADORA2B P29275 2/20 0.52
▸ AHCY P23526 7/20 0.47
▸ DNMT1 P26358 1/20 0.46
▸ DNMT3B Q9UBC3 1/20 0.46
▸ ADORA1 P30542 2/20 0.43
▸ ADORA3 P0DMS8 2/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ SLC28A1 O00337 1/20 0.41
▸ MAP3K7 O43318 1/20 0.41
▸ SLC28A2 O43868 1/20 0.41
▸ GAPDH P04406 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ STAT6 P42226 1/20 0.41
▸ PI4KA P42356 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PI4K2B Q8TCG2 1/20 0.41
▸ DOT1L Q8TEK3 1/20 0.41

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
SCHEMBL14134511 0.88 ADORA2A (0.47) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL13396668 0.85 AHCY (0.62) ADORA2AADORA2BAHCYADORA1ADORA3
SCHEMBL14134565 0.78 ADORA2A (0.45) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL14134547 0.76 AHCY (0.53) ADORA2AADORA2BAHCYDNMT1DNMT3B
SCHEMBL17659034 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1
SCHEMBL13820095 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1
SCHEMBL18490353 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1
SCHEMBL12556357 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1
SCHEMBL26507720 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1
SCHEMBL4320935 0.75 ADORA2A (0.68) ADORA2AADORA2BDNMT1DNMT3BADORA1

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-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 — — US disclosed
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