SCHEMBL4820592

SCHEMBL4820592

NCCNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 6/20 0.73
P2RY1 P47900 4/20 0.71
P2RY2 P41231 3/20 0.71
TAS1R3 Q7RTX0 2/20 0.71
TAS1R1 Q7RTX1 2/20 0.71
SRC P12931 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
PRKAB2 O43741 1/20 0.71
TRPM2 O94759 1/20 0.71
LDHA P00338 1/20 0.71
ADRB2 P07550 1/20 0.71
FBP1 P09467 1/20 0.71
ADORA1 P30542 1/20 0.71
PRKAG1 P54619 1/20 0.71
PRKAA2 P54646 1/20 0.71
PDE4D Q08499 1/20 0.71
KCNH2 Q12809 1/20 0.71
PRKAA1 Q13131 1/20 0.71
PDE3A Q14432 1/20 0.71
P2RY11 Q96G91 1/20 0.71

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
SCHEMBL25698378 0.95 P2RX3 (0.72) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL20705924 0.95 P2RX3 (0.72) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL4820076 0.94 P2RX3 (0.71) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL216645 0.93 P2RX3 (0.70) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL6707298 0.92 DNPH1 (0.68) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL6707282 0.91 DNPH1 (0.73) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL15305350 0.91 P2RX3 (0.67) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL14948866 0.90 P2RX3 (0.66) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL8780669 0.90 DNPH1 (0.77) DNPH1P2RY1P2RY2TAS1R3TAS1R1
SCHEMBL8780682 0.90 DNPH1 (0.77) DNPH1P2RY1P2RY2TAS1R3TAS1R1

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