Phosphoric Acid

Phosphoric Acid

SCHEMBL28487138

O=P(O)(O)O.c1ccn2cccc2c1

nearest known ligand 0.71

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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
ALOX15 P16050 1/20 0.71
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA5A P35218 1/20 0.37
PTPN1 P18031 1/20 0.37
PGK1 P00558 3/20 0.34
PGK2 P07205 3/20 0.34
FDPS P14324 2/20 0.33
SRC P12931 2/20 0.33
MAPT P10636 2/20 0.33
GGPS1 O95749 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CFTR P13569 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32

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
Pyrophosphoric Acid SCHEMBL214829 0.87 ALOX15 (0.60) ALOX15CA2CA4CA5APTPN1
Ammonia Solution, Strong SCHEMBL28553518 0.82 ALOX15 (0.94) ALOX15MAPTPTGS1PTGS2KDM4E
Perchlorate SCHEMBL30006851 0.76 ALOX15 (0.71) ALOX15MAPTPTGS1KDM4ENPC1
Toluene SCHEMBL29091429 0.71 ALOX15 (0.71) ALOX15CA2MAPTKDM4ENPC1
Naphthalene SCHEMBL3796240 0.64 CYP2A6 (0.57) CA2CA4CA5APTPN1PGK1
Naphthalene SCHEMBL19062554 0.64 CYP2A6 (0.57) CA2CA4CA5APTPN1PGK1
Phosphoric Acid SCHEMBL4104685 0.64 CA2 (0.50) ALOX15CA2CA4CA5APTPN1
Triphenylene SCHEMBL1756536 0.64 CA2 (0.50) ALOX15CA2CA4CA5APTPN1
Naphthalene SCHEMBL1680172 0.64 CYP2A6 (0.57) CA2CA4CA5APTPN1PGK1
Naphthalene SCHEMBL30445823 0.64 CYP2A6 (0.57) CA2CA4CA5APTPN1PGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118207553-A Phosphated indolizine, derivative thereof, preparation method and application thereof 上海陶术生物科技有限公司 2024-06-18 CN claimed
CN-118207553-A Phosphated indolizine, derivative thereof, preparation method and application thereof 上海陶术生物科技有限公司 2024-06-18 CN disclosed
CN-118207553-A Phosphated indolizine, derivative thereof, preparation method and application thereof 上海陶术生物科技有限公司 2024-06-18 CN disclosed
CN-118207553-A Phosphated indolizine, derivative thereof, preparation method and application thereof 上海陶术生物科技有限公司 2024-06-18 CN disclosed
CN-111868146-A Composite materials comprising mechanical ligands 纳诺科尔有限公司 2020-10-30 CN disclosed