Phosphoric Acid

Phosphoric Acid

SCHEMBL6285652

CC(C)(C)c1cccc(C(C)(C)C)c1.CC(C)(C)c1cccc(C(C)(C)C)c1.O=P(O)(O)O

nearest known ligand 0.55

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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
HDAC8 Q9BY41 3/20 0.55
HDAC4 P56524 1/20 0.55
HDAC2 Q92769 1/20 0.55
PGK1 P00558 3/20 0.54
PGK2 P07205 3/20 0.54
ACHE P22303 3/20 0.50
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
HDAC6 Q9UBN7 2/20 0.46
HDAC3 O15379 1/20 0.46
KIF11 P52732 1/20 0.44
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
PTPRC P08575 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GABRA1 P14867 1/20 0.42

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 SCHEMBL21327914 1.00 HDAC8 (0.55) HDAC8HDAC4HDAC2PGK1PGK2
Phosphoric Acid SCHEMBL28929945 1.00 HDAC8 (0.55) HDAC8HDAC4HDAC2PGK1PGK2
Phosphoric Acid SCHEMBL29023601 1.00 HDAC8 (0.55) HDAC8HDAC4HDAC2PGK1PGK2
SCHEMBL28718804 0.91 PGK1 (0.55) HDAC8HDAC4HDAC2PGK1PGK2
SCHEMBL28674254 0.91 PGK1 (0.55) HDAC8HDAC4HDAC2PGK1PGK2
Phosphoric Acid SCHEMBL8927513 0.85 GABRA1 (0.57) HDAC8HDAC4HDAC2PGK1PGK2
SCHEMBL129151 0.84 HDAC8 (0.56) HDAC8HDAC4HDAC2ACHERXRA
Hydrochloric Acid SCHEMBL9330450 0.84 HDAC8 (0.48) HDAC8HDAC4HDAC2PGK1PGK2
Phosphoric Acid SCHEMBL28954909 0.84 HDAC8 (0.48) HDAC8HDAC4HDAC2PGK1PGK2
Tert-Butylbenzene SCHEMBL6285328 0.83 PTPN1 (0.54) HDAC8HDAC4HDAC2PGK1PGK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6960553-B2 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. (JP) 2005-11-01 US disclosed
US-20030186810-A1 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. 2003-10-02 US disclosed