Adenosine Triphosphate

Adenosine Triphosphate

SCHEMBL29670849

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O.[Cu+4]

nearest known ligand 0.84

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 8/20 0.79
P2RY11 Q96G91 3/20 0.79
ENPP1 P22413 2/20 0.76
BLM P54132 2/20 0.75
TSHR P16473 1/20 0.75
KDM4E B2RXH2 1/20 0.75
LMNA P02545 1/20 0.75
P2RY2 P41231 3/20 0.73
SRC P12931 2/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
P2RX1 P51575 1/20 0.73
P2RX3 P56373 1/20 0.73
P2RX4 Q99571 1/20 0.73
P2RX2 Q9UBL9 1/20 0.73
ALDH1A1 P00352 1/20 0.73
TRPM2 O94759 2/20 0.73
DNPH1 O43598 1/20 0.73
PRKAB2 O43741 1/20 0.73
LDHA P00338 1/20 0.73
ADRB2 P07550 1/20 0.73

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 Triphosphate SCHEMBL926537 1.00 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL193646 0.99 P2RY1 (0.80) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL29905572 0.99 P2RY1 (0.80) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL29576424 0.99 P2RY1 (0.80) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL30606657 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL31149196 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL29041389 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL3134374 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Adenosine Triphosphate SCHEMBL924732 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR
Lithium Ion SCHEMBL28406951 0.98 P2RY1 (0.79) P2RY1P2RY11ENPP1BLMTSHR

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-2022114681-A1 CLEANSER COMPOSITION WITH ENHANCED ACTIVE SUBSTANCE DELIVERY 주식회사 엘지생활건강 2022-06-02 WO disclosed