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Sugi Predict / Compounds / Adenosine Phosphate

Adenosine Phosphate

Adenosine Phosphate

SCHEMBL15670860

N[C@@H](Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.Oc1ccco1

nearest known ligand 0.64

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 4/20 0.64
▸ P2RY2 P41231 3/20 0.64
▸ TRPM2 O94759 2/20 0.64
▸ DNPH1 O43598 2/20 0.64
▸ SRC P12931 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ PRKAB2 O43741 1/20 0.64
▸ LDHA P00338 1/20 0.64
▸ ADRB2 P07550 1/20 0.64
▸ FBP1 P09467 1/20 0.64
▸ ADORA1 P30542 1/20 0.64
▸ PRKAG1 P54619 1/20 0.64
▸ PRKAA2 P54646 1/20 0.64
▸ PDE4D Q08499 1/20 0.64
▸ KCNH2 Q12809 1/20 0.64
▸ PRKAA1 Q13131 1/20 0.64
▸ PDE3A Q14432 1/20 0.64
▸ TAS1R3 Q7RTX0 1/20 0.64
▸ TAS1R1 Q7RTX1 1/20 0.64
▸ P2RY11 Q96G91 1/20 0.64

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
Adenosine Phosphate SCHEMBL15670528 0.96 P2RY1 (0.66) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670947 0.94 P2RY1 (0.73) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670573 0.92 P2RY1 (0.70) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670263 0.91 P2RY1 (0.69) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670765 0.90 P2RY1 (0.68) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15671098 0.90 P2RY1 (0.67) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15671063 0.89 P2RY1 (0.76) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670878 0.89 P2RY1 (0.66) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15671447 0.89 P2RY1 (0.66) P2RY1P2RY2TRPM2DNPH1SRC
Adenosine Phosphate SCHEMBL15670859 0.88 P2RY1 (0.65) P2RY1P2RY2TRPM2DNPH1SRC

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
EP-2914131-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 — — EP disclosed
WO-2014068044-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 — — WO disclosed