Phosphoric Acid

Phosphoric Acid

SCHEMBL10684644

CCOc1ccc(C=Cc2nc3cccc(C(=O)O)c3[nH]2)cc1OC.O=P(O)(O)O

nearest known ligand 0.54

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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 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.54
▸ RAB9A P51151 7/20 0.54
▸ MAPT P10636 5/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ KMT2A Q03164 5/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ ATM Q13315 1/20 0.50
▸ KDM4E B2RXH2 3/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TUBB1 Q9H4B7 2/20 0.41
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 1/20 0.40
▸ TUBA1B P68363 1/20 0.40
▸ TUBA4A P68366 1/20 0.40
▸ TUBB4B P68371 1/20 0.40
▸ TUBB3 Q13509 1/20 0.40

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
SCHEMBL10684882 0.93 NPC1 (0.62) NPC1RAB9AMAPTALDH1A1LMNA
Phosphoric Acid SCHEMBL10788725 0.93 KMT2A (0.49) NPC1RAB9AMAPTALDH1A1LMNA
Phosphoric Acid SCHEMBL10681481 0.90 KMT2A (0.51) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL10687241 0.89 NPC1 (0.48) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL10687598 0.88 KMT2A (0.53) NPC1RAB9AMAPTALDH1A1LMNA
Bromide SCHEMBL10687727 0.88 KMT2A (0.52) NPC1RAB9AMAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL10692550 0.88 KMT2A (0.52) NPC1RAB9AMAPTALDH1A1LMNA
Phosphoric Acid SCHEMBL10687450 0.87 RAB9A (0.43) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL10689917 0.87 NPC1 (0.50) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL10685997 0.86 KMT2A (0.54) NPC1RAB9AMAPTALDH1A1LMNA

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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