SCHEMBL4823181

SCHEMBL4823181

O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(Cl)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 7/20 0.72
P2RY1 P47900 6/20 0.72
P2RX2 Q9UBL9 6/20 0.72
P2RY2 P41231 3/20 0.72
P2RX1 P51575 3/20 0.72
P2RX4 Q99571 2/20 0.72
SRC P12931 2/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
ALDH1A1 P00352 2/20 0.72
RNASEL Q05823 1/20 0.69
TRPM2 O94759 2/20 0.68
MACROD2 A1Z1Q3 1/20 0.68
SIRT6 Q8N6T7 1/20 0.68
MACROD1 Q9BQ69 1/20 0.68
GPR17 Q13304 1/20 0.67
DNPH1 O43598 1/20 0.66
PRKAB2 O43741 1/20 0.66
LDHA P00338 1/20 0.66
ADRB2 P07550 1/20 0.66
FBP1 P09467 1/20 0.66

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
SCHEMBL20673348 0.99 P2RY1 (0.74) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL1980912 0.99 P2RY1 (0.74) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL16247706 0.99 P2RY1 (0.74) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL20277564 0.93 P2RX3 (0.62) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL15038133 0.92 P2RY1 (0.65) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL622623 0.92 DNPH1 (0.77) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL20277501 0.92 DNPH1 (0.77) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL20282659 0.92 DNPH1 (0.77) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL20277541 0.92 DNPH1 (0.77) P2RX3P2RY1P2RX2P2RY2P2RX1
SCHEMBL20277566 0.92 P2RY1 (0.72) P2RX3P2RY1P2RX2P2RY2P2RX1

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-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