Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL26646343

CC(=O)N[C@H]1C(OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.57
▸ THRB P10828 1/20 0.57
▸ MAPK1 P28482 2/20 0.55
▸ CD69 Q07108 1/20 0.49
▸ P2RY14 Q15391 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ P2RY2 P41231 1/20 0.48
▸ P2RY4 P51582 1/20 0.48
▸ P2RY6 Q15077 1/20 0.48
▸ POLB P06746 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL29013440 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL15334201 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL5679031 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL18710872 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL29735890 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL317138 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL7152633 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL22410446 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL20552181 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14
SCHEMBL18700558 0.96 ALDH1A1 (0.61) ALDH1A1THRBMAPK1CD69P2RY14

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-2023217179-A1 USE OF MANNOSE IN INHIBITING PYROPTOSIS OR RELIEVING TOXIC AND SIDE EFFECTS OF CHEMOTHERAPY DRUG 厦门大学 2023-11-16 — — WO disclosed
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