SCHEMBL28796094

SCHEMBL28796094

NC(=O)NOP(=O)(OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 7/20 0.72
▸ P2RY2 P41231 4/20 0.72
▸ P2RX1 P51575 4/20 0.72
▸ P2RX3 P56373 4/20 0.72
▸ SRC P12931 2/20 0.72
▸ SMN1; SMN2 Q16637 2/20 0.72
▸ P2RX2 Q9UBL9 2/20 0.72
▸ ALDH1A1 P00352 2/20 0.72
▸ P2RX4 Q99571 1/20 0.72
▸ TRPM2 O94759 2/20 0.71
▸ TAS1R3 Q7RTX0 2/20 0.71
▸ TAS1R1 Q7RTX1 2/20 0.71
▸ DNPH1 O43598 1/20 0.71
▸ PRKAB2 O43741 1/20 0.71
▸ LDHA P00338 1/20 0.71
▸ ADRB2 P07550 1/20 0.71
▸ FBP1 P09467 1/20 0.71
▸ ADORA1 P30542 1/20 0.71
▸ PRKAG1 P54619 1/20 0.71
▸ PRKAA2 P54646 1/20 0.71

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
SCHEMBL5838786 0.92 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL28755762 0.92 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL3792441 0.92 P2RY1 (0.82) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL28367704 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL459771 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL6242721 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL459997 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL2321068 0.91 P2RY1 (0.81) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL28646263 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC
SCHEMBL1746647 0.91 P2RY1 (0.84) P2RY1P2RY2P2RX1P2RX3SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102565352-A Determination method of ammonia (ammonia ions) and diagnosis/determination kit for ammonia (ammonia ions) SUZHOU ANJ BIOTECH CO LTD 2012-07-11 — — CN claimed
CN-102539703-A Ammonia (ammonia ion) measurement method and ammonia (ammonia ion) diagnosis/measurement kit SUZHOU ANJ BIOTECH CO LTD 2012-07-04 — — CN claimed
CN-102565352-A Determination method of ammonia (ammonia ions) and diagnosis/determination kit for ammonia (ammonia ions) SUZHOU ANJ BIOTECH CO LTD 2012-07-11 — — CN disclosed
CN-102539703-A Ammonia (ammonia ion) measurement method and ammonia (ammonia ion) diagnosis/measurement kit SUZHOU ANJ BIOTECH CO LTD 2012-07-04 — — CN disclosed
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