SCHEMBL4820076

SCHEMBL4820076

NCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 3/20 0.71
P2RX2 Q9UBL9 3/20 0.71
DNPH1 O43598 5/20 0.70
P2RY1 P47900 3/20 0.68
TAS1R3 Q7RTX0 2/20 0.68
TAS1R1 Q7RTX1 2/20 0.68
SRC P12931 2/20 0.68
P2RY2 P41231 2/20 0.68
PRKAB2 O43741 1/20 0.68
TRPM2 O94759 1/20 0.68
LDHA P00338 1/20 0.68
ADRB2 P07550 1/20 0.68
FBP1 P09467 1/20 0.68
ADORA1 P30542 1/20 0.68
PRKAG1 P54619 1/20 0.68
PRKAA2 P54646 1/20 0.68
PDE4D Q08499 1/20 0.68
KCNH2 Q12809 1/20 0.68
PRKAA1 Q13131 1/20 0.68
PDE3A Q14432 1/20 0.68

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
SCHEMBL216645 0.99 P2RX3 (0.70) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL25698378 0.97 P2RX3 (0.72) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL20705924 0.97 P2RX3 (0.72) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL4820592 0.94 DNPH1 (0.73) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL15305350 0.93 P2RX3 (0.67) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL14948866 0.93 P2RX3 (0.66) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL4208216 0.93 P2RX3 (0.84) P2RX3P2RX2DNPH1P2RY1SRC
SCHEMBL30853828 0.92 P2RX3 (0.82) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL8738522 0.92 P2RX3 (0.82) P2RX3P2RX2DNPH1P2RY1TAS1R3
SCHEMBL4217929 0.92 P2RX3 (0.82) P2RX3P2RX2DNPH1P2RY1TAS1R3

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-20040241649-A1 RNA CONTAINING COENZYMES, BIOTIN, OR FLUOROPHORES, AND METHODS FOR THEIR PREPARATION AND USE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2004-12-02 US claimed
US-7323319-B2 RNA containing coenzymes, biotin, or fluorophores, and methods for their preparation and use THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2008-01-29 US disclosed
US-20040241649-A1 RNA CONTAINING COENZYMES, BIOTIN, OR FLUOROPHORES, AND METHODS FOR THEIR PREPARATION AND USE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2004-12-02 US disclosed