SCHEMBL4370169

SCHEMBL4370169

Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)C(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)C1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.73
RNASEL Q05823 3/20 0.72
P2RY2 P41231 4/20 0.70
P2RY1 P47900 4/20 0.67
P2RX1 P51575 2/20 0.67
P2RX3 P56373 2/20 0.67
P2RX2 Q9UBL9 2/20 0.67
SRC P12931 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
P2RX4 Q99571 1/20 0.67
ALDH1A1 P00352 1/20 0.67
DNPH1 O43598 1/20 0.67
PRKAB2 O43741 1/20 0.67
TRPM2 O94759 1/20 0.67
LDHA P00338 1/20 0.67
ADRB2 P07550 1/20 0.67
FBP1 P09467 1/20 0.67
PRKAG1 P54619 1/20 0.67
PRKAA2 P54646 1/20 0.67
PDE4D Q08499 1/20 0.67

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
SCHEMBL30918598 1.00 ADORA1 (0.73) ADORA1RNASELP2RY2P2RY1P2RX1
SCHEMBL536567 1.00 ADORA1 (0.73) ADORA1RNASELP2RY2P2RY1P2RX1
SCHEMBL29539212 0.99 ADORA1 (0.74) ADORA1RNASELP2RY2P2RY1P2RX1
SCHEMBL8167524 0.99 ADORA1 (0.74) ADORA1RNASELP2RY2P2RY1P2RX1
SCHEMBL23250438 0.94 ADORA1 (0.84) ADORA1RNASELP2RY2P2RX1P2RX3
SCHEMBL7706114 0.94 ADORA1 (0.84) ADORA1RNASELP2RY2P2RX1P2RX3
SCHEMBL23250436 0.94 ADORA1 (0.84) ADORA1RNASELP2RY2P2RX1P2RX3
SCHEMBL11776064 0.93 ADORA1 (0.85) ADORA1RNASELP2RY2
SCHEMBL7785138 0.93 ADORA1 (0.85) ADORA1RNASELP2RY2
SCHEMBL668585 0.92 RNASEL (0.77) ADORA1RNASELP2RY2P2RY1P2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090186358-A1 Pathway Analysis of Cell Culture Phenotypes and Uses Thereof WYETH (US) 2009-07-23 US disclosed