Triphosphate

Triphosphate

SCHEMBL6461190

Nc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1.O=P(O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.68
PNP P00491 4/20 0.42
POLG P54098 2/20 0.41
POLB P06746 2/20 0.41
POLA1 P09884 1/20 0.41
ADORA2B P29275 1/20 0.34
HPRT1 P00492 3/20 0.34
DYRK1A Q13627 1/20 0.33
XDH P47989 2/20 0.33

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
SCHEMBL22144 0.82 MAPT (1.00) MAPTPNPADORA2BDYRK1AXDH
SCHEMBL447389 0.75 MAPT (0.84) MAPTPNPADORA2BDYRK1AXDH
Hydrochloric Acid SCHEMBL7296117 0.73 MAPT (0.81) MAPTPNPADORA2BDYRK1AXDH
Triphosphate SCHEMBL12813216 0.73 PNP (0.70) MAPTPNPPOLGPOLBPOLA1
Triphosphate SCHEMBL76054 0.73 PNP (0.70) MAPTPNPPOLGPOLBPOLA1
Triphosphate SCHEMBL28101758 0.73 PNP (0.50) PNPPOLGPOLBPOLA1HPRT1
Guanine SCHEMBL29844110 0.72 PNP (0.68) MAPTPNPPOLGPOLBPOLA1
Triphosphate SCHEMBL28841044 0.72 PNP (0.68) MAPTPNPPOLGPOLBPOLA1
Triphosphate SCHEMBL28408391 0.71 FDPS (0.45) PNPPOLGPOLBPOLA1
SCHEMBL3513712 0.71 MAPT (0.75) MAPTPNPADORA2BDYRK1AXDH

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
US-20050123937-A1 Methods for the electrochemical detection of target compounds UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL, THE 2005-06-09 US disclosed
WO-2004092708-A2 METHODS FOR THE ELECTROCHEMICAL DETECTION OF TARGET COMPOUNDS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2004-10-28 WO disclosed