SCHEMBL14435669

SCHEMBL14435669

Nc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](CO)[C@H](O)C1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NADK O95544 2/20 0.79
HSPA8 P11142 3/20 0.78
HSPA5 P11021 2/20 0.78
RXFP1 Q9HBX9 1/20 0.71
GAPDH P04406 3/20 0.68
HSD17B10 Q99714 1/20 0.68
SMN1; SMN2 Q16637 2/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
HBB P68871 1/20 0.67
ADORA3 P0DMS8 3/20 0.63
SLC28A2 O43868 2/20 0.62
DPP4 P27487 1/20 0.62
MEN1 O00255 1/20 0.62
SLC28A1 O00337 1/20 0.62
MAP3K7 O43318 1/20 0.62
MAPK1 P28482 1/20 0.62
ADORA2A P29274 1/20 0.62
ADORA2B P29275 1/20 0.62
ADORA1 P30542 1/20 0.62

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
SCHEMBL12030991 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL20419274 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL6671819 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL13587343 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL440925 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL440926 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL1106674 1.00 NADK (0.79) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL29707221 0.99 NADK (0.78) NADKHSPA8HSPA5RXFP1GAPDH
SCHEMBL28823544 0.99 NADK (0.78) NADKHSPA8HSPA5RXFP1GAPDH
Phosphoric Acid SCHEMBL8628967 0.94 NADK (0.72) NADKHSPA8HSPA5RXFP1GAPDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240026358-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2024-01-25 US disclosed
WO-2007091056-A2 BICYCLIC COMPOUNDS AND THEIR USE THE UNIVERSITY OF YORK (GB) 2007-08-16 WO disclosed