Phosphoric Acid

Phosphoric Acid

SCHEMBL3326768

CCn1cnc(C)c1.O=P(O)(O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

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 19)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.42
PLAA Q9Y263 1/20 0.42
ALPG P10696 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
MAP3K5 Q99683 1/20 0.40
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2B6 P20813 1/20 0.40
SMYD3 Q9H7B4 1/20 0.39
CPB2 Q96IY4 3/20 0.35
QPCT Q16769 6/20 0.34
FDPS P14324 2/20 0.33
KMT2A Q03164 1/20 0.33
CPB1 P15086 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP19A1 P11511 1/20 0.33

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
Phosphoric Acid SCHEMBL3326759 1.00 ALPL (0.42) ALPLPLAAALPGCYP3A4CYP2C9
Bromide SCHEMBL28926580 0.86
SCHEMBL25210345 0.80 CYP3A4 (0.42) ALPLPLAAALPGCYP3A4CYP2C9
SCHEMBL28452300 0.75 FDPS (0.54) ALPLPLAAALPGFDPS
SCHEMBL12018590 0.74 ALPL (0.40) ALPLPLAAALPGQPCTKMT2A
SCHEMBL10529956 0.73
Phosphoric Acid SCHEMBL28561554 0.69 CPA1 (0.37) CPB2FDPS
SCHEMBL634200 0.68 CYP1A2 (0.45) ALPLPLAACYP3A4CYP2C9CYP2C19
SCHEMBL30691991 0.68 CYP2E1 (0.43) ALPLPLAACYP3A4CYP2C9CYP2C19
Acetic Acid SCHEMBL29204930 0.68 CPB2 (0.47) ALPLPLAAALPGCPB2QPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394181-B2 Selectively permeable material, method for producing selectively permeable membrane structure, selectively permeable membrane structure, and air conditioning system SHIN-ETSU POLYMER CO., LTD. (JP) 2013-03-12 US disclosed
US-20100132559-A1 SELECTIVELY PERMEABLE MATERIAL, METHOD FOR PRODUCING SELECTIVELY PERMEABLE MEMBRANE STRUCTURE, SELECTIVELY PERMEABLE MEMBRANE STRUCTURE, AND AIR CONDITIONING SYSTEM SHIN-ETSU POLYMER CO., LTD. (JP) 2010-06-03 US disclosed
EP-2098281-A1 SELECTIVELY PERMEABLE MATERIAL, METHOD FOR PRODUCING SELECTIVELY PERMEABLE MEMBRANE STRUCTURE, SELECTIVELY PERMEABLE MEMBRANE STRUCTURE, AND AIR CONDITIONING SYSTEM Shin-Etsu Polymer Co. Ltd. (JP) 2009-09-09 EP disclosed