SCHEMBL1940955

SCHEMBL1940955

O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEL Q05823 13/20 0.76
DNPH1 O43598 1/20 0.70
PRKAB2 O43741 1/20 0.70
TRPM2 O94759 1/20 0.70
LDHA P00338 1/20 0.70
ADRB2 P07550 1/20 0.70
FBP1 P09467 1/20 0.70
SRC P12931 1/20 0.70
ADORA1 P30542 1/20 0.70
P2RY2 P41231 1/20 0.70
P2RY1 P47900 1/20 0.70
PRKAG1 P54619 1/20 0.70
PRKAA2 P54646 1/20 0.70
PDE4D Q08499 1/20 0.70
KCNH2 Q12809 1/20 0.70
PRKAA1 Q13131 1/20 0.70
PDE3A Q14432 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
TAS1R3 Q7RTX0 1/20 0.70
TAS1R1 Q7RTX1 1/20 0.70

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
SCHEMBL4970108 0.96 RNASEL (0.84) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL7451512 0.95 RNASEL (0.70) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL11334246 0.92 DNPH1 (0.67) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL11645423 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL19255 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL25168081 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL29358651 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL16141757 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL24145247 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA
SCHEMBL161318 0.92 DNPH1 (0.79) RNASELDNPH1PRKAB2TRPM2LDHA

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-20110130285-A1 COMPOSITION FOR PROMOTING ROOT NODULE FORMATION OF PLANTS AND A METHOD FOR PROMOTING ROOT NODULE FORMATION OF PLANTS AJINOMOTO CO., INC. (JP) 2011-06-02 US disclosed