SCHEMBL18822973

SCHEMBL18822973

CO[P@@](=O)(S)O[C@H]1[C@@H](F)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1CO[P@@](=O)(S)O[C@@H]1C[C@@H](C)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.51
▸ P2RY1 P47900 4/20 0.47
▸ P2RY2 P41231 3/20 0.47
▸ SRC P12931 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ DNPH1 O43598 1/20 0.47
▸ PRKAB2 O43741 1/20 0.47
▸ TRPM2 O94759 1/20 0.47
▸ LDHA P00338 1/20 0.47
▸ ADRB2 P07550 1/20 0.47
▸ FBP1 P09467 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ PRKAG1 P54619 1/20 0.47
▸ PRKAA2 P54646 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ PRKAA1 Q13131 1/20 0.47
▸ PDE3A Q14432 1/20 0.47
▸ TAS1R3 Q7RTX0 1/20 0.47
▸ TAS1R1 Q7RTX1 1/20 0.47

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
SCHEMBL22080564 0.88 NT5E (0.51) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20691954 0.88 NT5E (0.51) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL22080123 0.88 NT5E (0.51) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20691346 0.87 NT5E (0.49) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL22080505 0.86 NT5E (0.53) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20691370 0.82 RNASEL (0.54) NT5EP2RY1P2RY2SRCP2RX1
SCHEMBL23476718 0.81 NT5E (0.55) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL22930637 0.81 NT5E (0.61) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL24722324 0.81 RNASEL (0.57) NT5EP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL24258560 0.81 NT5E (0.43) NT5EP2RY1P2RY2SRCSMN1; SMN2

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
WO-2017075477-A1 COMPOSITIONS AND METHODS FOR ACTIVATING \"STIMULATOR OF INTERFERON GENE\"-DEPENDENT SIGNALLING Aduro Biotech, Inc. (US) 2017-05-04 — — WO disclosed
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