Phosphoric Acid

Phosphoric Acid

SCHEMBL9300595

NNS(=O)(=O)c1ccccc1Oc1ccccc1S(=O)(=O)NN.NNS(=O)(=O)c1ccccc1Oc1ccccc1S(=O)(=O)NN.NNS(=O)(=O)c1ccccc1Oc1ccccc1S(=O)(=O)NN.O=P([O-])([O-])[O-].[Na+].[Na+].[Na+]

nearest known ligand 0.40

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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
CASP1 P29466 7/20 0.37
CA9 Q16790 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
KAT6A Q92794 1/20 0.33
CA12 O43570 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MRGPRX1 Q96LB2 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
MMP14 P50281 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
SCHEMBL128257 0.89 CASP1 (0.42) CASP1CA9CA1CA2CA12
SCHEMBL30695942 0.89 CASP1 (0.42) CASP1CA9CA1CA2CA12
SCHEMBL4580463 0.81 CASP1 (0.41) CASP1CA9CA1CA2KAT6A
SCHEMBL11400434 0.79 SMN1; SMN2 (0.49) CASP1LMNAMAPTMMP2MMP3
SCHEMBL5501632 0.75 HTR6 (0.55) CA9CA1CA2KAT6ACA12
SCHEMBL1427884 0.73 CA1 (0.48) CA9CA1CA2CA12CA6
SCHEMBL418590 0.71 ALPL (0.52) CA2MAPTMRGPRX1
SCHEMBL5675703 0.71 ALDH1A1 (0.51) CA9CA1CA2CA12LMNA
SCHEMBL10892724 0.71 CYP1A2 (0.51) CASP1CA9CA1CA2KAT6A
SCHEMBL29352063 0.70 DUSP5 (0.44) CASP1CA9CA1CA2CA12

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-5283215-A Light burned magnesia, microfine calcined alumina, spinel of magnesia-alumina and/or fused or sintered alumina; spalling and erosion resistant Harima, Ceramic Co., Ltd. (JP) 1994-02-01 US disclosed