Phosphoric Acid

Phosphoric Acid

SCHEMBL10686961

COc1ccc(/C=C/c2nc3c(C(=O)O)cccc3[nH]2)c(OC)c1OC.O=P(O)(O)O

nearest known ligand 0.45

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Phosphoric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 4/20 0.45
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PARP1 P09874 5/20 0.41
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP1A1 P04798 2/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2D6 P10635 2/20 0.39
▸ CYP1B1 Q16678 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL10687218 0.96 DHODH (0.48) DHODHNPC1RAB9AMEN1KMT2A
SCHEMBL10690922 0.89 DHODH (0.49) DHODHNPC1RAB9AMEN1KMT2A
SCHEMBL10686994 0.88 NPC1 (0.41) DHODHNPC1RAB9AMEN1KMT2A
Phosphoric Acid SCHEMBL10687005 0.85 ABL1 (0.43) NPC1RAB9AMEN1KMT2ALMNA
Phosphoric Acid SCHEMBL10788694 0.83 DHODH (0.48) DHODHNPC1RAB9AMEN1KMT2A
Phosphoric Acid SCHEMBL10687431 0.82 DHODH (0.48) DHODHMEN1KMT2APARP1KDM4E
SCHEMBL10688446 0.82 DHODH (0.54) DHODHNPC1RAB9AMEN1KMT2A
Phosphoric Acid SCHEMBL10689645 0.82 DHODH (0.49) DHODHPARP1ABCG2KDM4EHPGD
SCHEMBL10689508 0.81 DHODH (0.50) DHODHNPC1RAB9AMEN1KMT2A
SCHEMBL10687494 0.81 DHODH (0.50) DHODHMEN1KMT2APARP1ABCG2

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
US-4769384-A ANTIULCER AGENTS NIPPON SHINYAKU CO. LTD. (JP) 1988-09-06 — — US disclosed
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