SCHEMBL14102406

SCHEMBL14102406

Nc1ncnc2c1ncn2[C@@H]1O[C@H](/C=C/P(=O)(O)O)[C@@H](O)[C@H]1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHCY P23526 15/20 0.64
NT5E P21589 1/20 0.58
HIF1A Q16665 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
DNPH1 O43598 1/20 0.52
PRKAB2 O43741 1/20 0.52
TRPM2 O94759 1/20 0.52
LDHA P00338 1/20 0.52
ADRB2 P07550 1/20 0.52
FBP1 P09467 1/20 0.52
SRC P12931 1/20 0.52
ADORA1 P30542 1/20 0.52
P2RY2 P41231 1/20 0.52
P2RY1 P47900 1/20 0.52
PRKAG1 P54619 1/20 0.52
PRKAA2 P54646 1/20 0.52
PDE4D Q08499 1/20 0.52
KCNH2 Q12809 1/20 0.52
PRKAA1 Q13131 1/20 0.52

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
SCHEMBL3315677 1.00 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL3315660 1.00 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL14102397 1.00 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL13396706 0.92 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL3317481 0.92 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL3317471 0.92 AHCY (0.64) AHCYNT5EHIF1ATMEM97SIGMAR1
SCHEMBL4744376 0.92 AHCY (0.73) AHCYHIF1ATMEM97SIGMAR1DNPH1
SCHEMBL3313598 0.92 AHCY (0.73) AHCYHIF1ATMEM97SIGMAR1DNPH1
SCHEMBL3313652 0.92 AHCY (0.73) AHCYHIF1ATMEM97SIGMAR1DNPH1
SCHEMBL3313635 0.92 AHCY (0.73) AHCYHIF1ATMEM97SIGMAR1DNPH1

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
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 WO disclosed