SCHEMBL8616900

SCHEMBL8616900

Nc1ncnc2c1ncn2[C@H]1C[C@H](F)[C@@H](COP(=O)(O)O)O1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 2/20 0.66
▸ DNPH1 O43598 1/20 0.66
▸ PRKAB2 O43741 1/20 0.66
▸ TRPM2 O94759 1/20 0.66
▸ LDHA P00338 1/20 0.66
▸ ADRB2 P07550 1/20 0.66
▸ FBP1 P09467 1/20 0.66
▸ SRC P12931 1/20 0.66
▸ ADORA1 P30542 1/20 0.66
▸ P2RY2 P41231 1/20 0.66
▸ PRKAG1 P54619 1/20 0.66
▸ PRKAA2 P54646 1/20 0.66
▸ PDE4D Q08499 1/20 0.66
▸ KCNH2 Q12809 1/20 0.66
▸ PRKAA1 Q13131 1/20 0.66
▸ PDE3A Q14432 1/20 0.66
▸ SMN1; SMN2 Q16637 1/20 0.66
▸ TAS1R3 Q7RTX0 1/20 0.66
▸ TAS1R1 Q7RTX1 1/20 0.66
▸ P2RY11 Q96G91 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
SCHEMBL21132954 0.93 POLB (0.62) P2RY1DNPH1PRKAB2TRPM2LDHA
SCHEMBL25565174 0.92 POLB (0.66) P2RY1TRPM2SRCP2RY2SMN1; SMN2
SCHEMBL21133333 0.92 RNASEL (0.58) P2RY1DNPH1PRKAB2TRPM2LDHA
SCHEMBL1062774 0.91 P2RX3 (0.66) P2RY1TRPM2SRCP2RY2SMN1; SMN2
SCHEMBL31069787 0.91 P2RX3 (0.66) P2RY1TRPM2SRCP2RY2SMN1; SMN2
SCHEMBL12932298 0.91 P2RX3 (0.66) P2RY1TRPM2SRCP2RY2SMN1; SMN2
SCHEMBL7882477 0.89 POLB (0.81) P2RY1DNPH1PRKAB2TRPM2LDHA
SCHEMBL4546151 0.89 POLB (0.81) P2RY1DNPH1PRKAB2TRPM2LDHA
SCHEMBL18785113 0.89 POLB (0.81) P2RY1DNPH1PRKAB2TRPM2LDHA
SCHEMBL543475 0.89 POLB (0.81) P2RY1DNPH1PRKAB2TRPM2LDHA

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-5756711-A Phospholipid derivatives of nucleosides and their use as anti-viral medicaments BOEHRINGER MANNHEIM GMBH (DE) 1998-05-26 — — US disclosed
US-5563257-A Phospholipid derivatives of nucleosides BOEHRINGER MANNHEIM GMBH (DE) 1996-10-08 — — US disclosed
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