Adenosine Phosphate

Adenosine Phosphate

SCHEMBL17144429

NCCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Adenosine Phosphate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 4/20 0.76
P2RY2 P41231 3/20 0.76
SRC P12931 2/20 0.76
SMN1; SMN2 Q16637 2/20 0.76
DNPH1 O43598 1/20 0.76
PRKAB2 O43741 1/20 0.76
TRPM2 O94759 1/20 0.76
LDHA P00338 1/20 0.76
ADRB2 P07550 1/20 0.76
FBP1 P09467 1/20 0.76
ADORA1 P30542 1/20 0.76
PRKAG1 P54619 1/20 0.76
PRKAA2 P54646 1/20 0.76
PDE4D Q08499 1/20 0.76
KCNH2 Q12809 1/20 0.76
PRKAA1 Q13131 1/20 0.76
PDE3A Q14432 1/20 0.76
TAS1R3 Q7RTX0 1/20 0.76
TAS1R1 Q7RTX1 1/20 0.76
P2RY11 Q96G91 1/20 0.76

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 SCHEMBL8365323 1.00 P2RY1 (0.76) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL15670547 0.98 P2RY1 (0.77) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL15670572 0.92 P2RY1 (0.64) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL1331852 0.92 P2RY1 (0.76) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL15670584 0.90 P2RY1 (0.78) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL15670859 0.90 P2RY1 (0.65) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL30151699 0.90 P2RY1 (0.70) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL15670721 0.89 P2RY1 (0.77) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL7225652 0.89 P2RY1 (0.77) P2RY1P2RY2SRCSMN1; SMN2DNPH1
Adenosine Phosphate SCHEMBL2406483 0.88 P2RY1 (0.81) P2RY1P2RY2SRCSMN1; SMN2DNPH1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170107254-A1 Modified Antimicrobial Peptides NOVABIOTICS LIMITED (GB) 2017-04-20 US disclosed
EP-3125918-A1 MODIFIED ANTIMICROBIAL PEPTIDES Novabiotics Limited (GB) 2017-02-08 EP disclosed
WO-2015150823-A1 MODIFIED ANTIMICROBIAL PEPTIDES NOVABIOTICS LIMITED (GB) 2015-10-08 WO disclosed