SCHEMBL8438661

SCHEMBL8438661

CC(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 4/20 0.64
▸ P2RY1 P47900 4/20 0.61
▸ P2RX1 P51575 2/20 0.61
▸ P2RX3 P56373 2/20 0.61
▸ P2RX2 Q9UBL9 2/20 0.61
▸ SRC P12931 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ P2RX4 Q99571 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ RNASEL Q05823 1/20 0.59
▸ TRPM2 O94759 2/20 0.58
▸ DNPH1 O43598 1/20 0.58
▸ PRKAB2 O43741 1/20 0.58
▸ LDHA P00338 1/20 0.58
▸ ADRB2 P07550 1/20 0.58
▸ FBP1 P09467 1/20 0.58
▸ ADORA1 P30542 1/20 0.58
▸ PRKAG1 P54619 1/20 0.58
▸ PRKAA2 P54646 1/20 0.58
▸ PDE4D Q08499 1/20 0.58

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
SCHEMBL800851 1.00 P2RY2 (0.64) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL800684 1.00 P2RY2 (0.64) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL800850 1.00 P2RY2 (0.64) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL5320373 0.91 P2RY2 (0.63) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL8441715 0.91 P2RY2 (0.62) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL8441738 0.91 P2RY2 (0.52) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL3164897 0.90 P2RY2 (0.65) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL11895432 0.89 P2RY2 (0.62) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL4261443 0.89 P2RY2 (0.64) P2RY2P2RY1P2RX1P2RX3P2RX2
SCHEMBL787408 0.89 AHCY (0.59) P2RY2P2RY1P2RX1P2RX3P2RX2

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-5902793-A ADMINISTERING TO MAMMAL GAMMA-MONOALKYL- OR GAMMA-ALKENYL-NUCLEOSIDE OR DEOXYNUCLEOSIDE TRIPHOSPHATE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-05-11 — — US claimed
US-5902793-A ADMINISTERING TO MAMMAL GAMMA-MONOALKYL- OR GAMMA-ALKENYL-NUCLEOSIDE OR DEOXYNUCLEOSIDE TRIPHOSPHATE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-05-11 — — US disclosed
US-5639653-A ADMINISTERING MONOALKYL- OR ALKENYL-PYROPHOSPHATE TO MAMMAL TO STIMULATE LYMPHOCYTE CELL GROWTH AND ENHANCE IMMUNE RESPONSE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY, A DIVISION OF YESHIVA UNIVERSTIY (US) 1997-06-17 — — US disclosed
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