SCHEMBL6511718

SCHEMBL6511718

C#CC[C@@]1(n2cc(N)c(N)nc2=O)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 7/20 0.41
P2RY4 P51582 4/20 0.41
P2RY6 Q15077 3/20 0.41
POLG P54098 1/20 0.40
P2RX1 P51575 3/20 0.38
P2RX3 P56373 3/20 0.38
P2RX2 Q9UBL9 1/20 0.38
P2RX4 Q99571 2/20 0.38
ENPP1 P22413 2/20 0.38
P2RY1 P47900 2/20 0.38
P2RY11 Q96G91 1/20 0.38
GPR17 Q13304 1/20 0.37
P2RY12 Q9H244 1/20 0.37

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
SCHEMBL31309815 0.87 P2RY2 (0.42) P2RY2P2RY4P2RY6POLGP2RX1
SCHEMBL18911836 0.86 P2RY6 (0.40) P2RY2P2RY4P2RY6POLGP2RX1
SCHEMBL6514738 0.84 P2RY2 (0.44) P2RY2P2RY4P2RY6P2RX3
SCHEMBL886859 0.84 POLG (0.41) P2RY2P2RY4P2RY6POLGP2RX1
SCHEMBL29862897 0.75 P2RY2 (0.45) P2RY2P2RY4P2RY6POLGP2RX1
SCHEMBL30140872 0.74 POLG (0.49) P2RY2P2RY4P2RY6POLG
SCHEMBL27186873 0.73 POLG (0.41) P2RY2P2RY4P2RY6POLGP2RX1
SCHEMBL28518605 0.72 POLG (0.47) P2RY2P2RY4P2RY6POLG
SCHEMBL5708922 0.72 POLG (0.48) P2RY2P2RY4P2RY6POLG
SCHEMBL3635669 0.72 POLG (0.46) P2RY2P2RY4P2RY6POLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050214759-A1 Enzymatic redox labelling of nucleic acids WLASSOF WJATSCHESSLAW 2005-09-29 US claimed
EP-1468006-A1 ENZYMATIC REDOX LABELLING OF NUCLEIC ACIDS UNISEARCH LIMITED (AU) 2004-10-20 EP claimed
WO-2003055898-A1 ENZYMATIC REDOX LABELLING OF NUCLEIC ACIDS UNISEARCH LIMITED (AU) 2003-07-10 WO claimed
US-20050214759-A1 Enzymatic redox labelling of nucleic acids WLASSOF WJATSCHESSLAW 2005-09-29 US disclosed
EP-1468006-A1 ENZYMATIC REDOX LABELLING OF NUCLEIC ACIDS UNISEARCH LIMITED (AU) 2004-10-20 EP disclosed
WO-2003055898-A1 ENZYMATIC REDOX LABELLING OF NUCLEIC ACIDS UNISEARCH LIMITED (AU) 2003-07-10 WO disclosed