SCHEMBL4359388

SCHEMBL4359388

O=P(O)(O)OC[C@H]1OC(c2ncc[nH]2)[C@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 3/20 0.53
UMPS P11172 1/20 0.48
HPRT1 P00492 1/20 0.47
IGF2R P11717 4/20 0.43
ATIC P31939 2/20 0.42
TAS1R3 Q7RTX0 3/20 0.42
TAS1R1 Q7RTX1 3/20 0.42
GART P22102 1/20 0.41
P2RY2 P41231 2/20 0.41
DNPH1 O43598 1/20 0.41
PRKAB2 O43741 1/20 0.41
TRPM2 O94759 1/20 0.41
LDHA P00338 1/20 0.41
ADRB2 P07550 1/20 0.41
SRC P12931 1/20 0.41
ADORA1 P30542 1/20 0.41
P2RY1 P47900 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA2 P54646 1/20 0.41
PDE4D Q08499 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
Phosphoric Acid SCHEMBL30522657 0.83 PYGL (0.45) SMN1; SMN2
SCHEMBL11284980 0.78 PYGL (0.50) SMN1; SMN2
SCHEMBL6489385 0.78 PYGL (0.50) SMN1; SMN2
SCHEMBL4193972 0.78 PYGL (0.50) SMN1; SMN2
SCHEMBL187957 0.78 FBP1 (0.50) FBP1UMPSATICTAS1R3TAS1R1
SCHEMBL3842183 0.76 PYGL (0.37) SMN1; SMN2
SCHEMBL11281748 0.74 FBP1 (0.43) FBP1UMPSHPRT1TAS1R3TAS1R1
SCHEMBL10695058 0.73 FBP1 (0.51) FBP1UMPSIGF2RTAS1R3TAS1R1
SCHEMBL5544571 0.73 UMPS (0.45) FBP1UMPSATICTAS1R3TAS1R1
SCHEMBL20154711 0.72 FBP1 (1.00) FBP1UMPSIGF2RATICDNPH1

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-20090186358-A1 Pathway Analysis of Cell Culture Phenotypes and Uses Thereof WYETH (US) 2009-07-23 US disclosed