SCHEMBL14930893

SCHEMBL14930893

Nc1nc2c([nH]c(=O)n2C2OC(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.44
P2RY2 P41231 6/20 0.39
PNP P00491 2/20 0.39
FUT5 Q11128 1/20 0.38
POLG P54098 1/20 0.38
UMPS P11172 1/20 0.37
TGM2 P21980 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
P2RY4 P51582 5/20 0.37
P2RY6 Q15077 5/20 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
SCHEMBL6465095 0.84 P2RX3 (0.61) P2RX3P2RY2FUT5UMPSTGM2
SCHEMBL14948862 0.84 P2RX3 (0.61) P2RX3P2RY2FUT5UMPSTGM2
SCHEMBL29868101 0.83 P2RX3 (0.60) P2RX3P2RY2FUT5UMPSTGM2
SCHEMBL14930996 0.79 STING1 (0.47) P2RY2FUT5P2RY4P2RY6
SCHEMBL15038134 0.76 P2RY2 (0.53) P2RX3P2RY2FUT5UMPSTGM2
SCHEMBL16160997 0.75 UMPS (0.51) P2RX3P2RY2PNPFUT5UMPS
8-Hydroxyguanosine SCHEMBL23633218 0.73 PNP (0.68) PNPMEN1KMT2A
8-Hydroxyguanosine SCHEMBL20419141 0.73 PNP (0.68) PNPMEN1KMT2A
8-Hydroxyguanosine SCHEMBL23982342 0.73 PNP (0.68) PNPMEN1KMT2A
8-Hydroxyguanosine SCHEMBL114651 0.73 PNP (0.68) PNPMEN1KMT2A

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-9428535-B2 Modified nucleosides, nucleotides, and nucleic acids, and uses thereof MODERNA THERAPEUTICS, INC. (US) 2016-08-30 US disclosed
US-20130115272-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF modeRNA Therapeutics (US) 2013-05-09 US disclosed