SCHEMBL10778019

SCHEMBL10778019

Nc1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(O)ncnc54)[C@H](O)[C@@H]3O)[C@H]2O)c(=O)n1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RNASEL Q05823 6/20 0.66
P2RY1 P47900 6/20 0.61
P2RY2 P41231 3/20 0.61
P2RX1 P51575 2/20 0.61
P2RX3 P56373 2/20 0.61
P2RX2 Q9UBL9 2/20 0.61
SRC P12931 1/20 0.61
P2RX4 Q99571 1/20 0.61
ALDH1A1 P00352 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MACROD2 A1Z1Q3 1/20 0.58
SIRT6 Q8N6T7 1/20 0.58
MACROD1 Q9BQ69 1/20 0.58
TRPM2 O94759 1/20 0.58
ENPP1 P22413 1/20 0.57

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
Cystetine Triphosphate SCHEMBL10778035 0.95 P2RY1 (0.65) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL432628 0.94 RNASEL (0.67) RNASELP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL28263983 0.90 P2RY1 (0.63) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL7677945 0.88 RNASEL (0.76) RNASELP2RY1P2RY2SRCSMN1; SMN2
Adenosine Phosphate SCHEMBL6264787 0.88 P2RY1 (0.73) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL29468919 0.88 P2RY1 (0.80) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL11521155 0.87 RNASEL (0.70) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL11521146 0.87 RNASEL (0.70) RNASELP2RY1P2RY2P2RX1P2RX3
SCHEMBL8506608 0.87 P2RY2 (0.67) P2RY2
SCHEMBL16685314 0.85 P2RY2 (0.64) RNASELP2RY1P2RY2P2RX1P2RX3

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
EP-0071859-B1 LUMINESCENCE DETECTION DEVICE MILES LABORATORIES, INC. (US) 1987-02-04 EP disclosed