Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL27753070

CCOP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.N

nearest known ligand 0.82

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 7/20 0.82
▸ P2RY2 P41231 3/20 0.82
▸ SRC P12931 2/20 0.82
▸ SMN1; SMN2 Q16637 2/20 0.82
▸ P2RX1 P51575 2/20 0.82
▸ P2RX3 P56373 2/20 0.82
▸ ALDH1A1 P00352 2/20 0.82
▸ P2RX4 Q99571 1/20 0.82
▸ P2RX2 Q9UBL9 1/20 0.82
▸ TRPM2 O94759 2/20 0.79
▸ TAS1R3 Q7RTX0 2/20 0.79
▸ TAS1R1 Q7RTX1 2/20 0.79
▸ DNPH1 O43598 1/20 0.79
▸ PRKAB2 O43741 1/20 0.79
▸ LDHA P00338 1/20 0.79
▸ ADRB2 P07550 1/20 0.79
▸ FBP1 P09467 1/20 0.79
▸ ADORA1 P30542 1/20 0.79
▸ PRKAG1 P54619 1/20 0.79
▸ PRKAA2 P54646 1/20 0.79

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
SCHEMBL14571169 0.95 P2RY1 (0.91) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL2166658 0.95 P2RY1 (0.91) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL31210200 0.95 P2RY1 (0.91) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL5055892 0.94 P2RY1 (0.92) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL3046222 0.94 P2RY1 (0.92) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL4326222 0.92 P2RY1 (0.81) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL21067301 0.92 P2RY1 (0.81) P2RY1P2RY2SRCSMN1; SMN2P2RX1
SCHEMBL29577810 0.92 P2RY1 (0.81) P2RY1P2RY2SRCSMN1; SMN2P2RX1
Diadenosine Tetraphosphate SCHEMBL29823785 0.91 P2RY1 (0.98) P2RY1P2RY2SRCSMN1; SMN2P2RX1
Ammonia Solution, Strong SCHEMBL27732769 0.91 P2RY1 (0.79) P2RY1P2RY2SRCSMN1; SMN2P2RX1

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
CN-101316810-A Ionic liquids BIONIQS LTD (GB) 2008-12-03 — — CN disclosed
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