Phosphoric Acid

Phosphoric Acid

SCHEMBL8763237

C=C(C)C(=O)OCC(O)C[N+](C)(C)C.C=C(C)C(=O)OCC(O)C[N+](C)(C)C.C=C(C)C(=O)OCC(O)C[N+](C)(C)C.O=P([O-])([O-])[O-]

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRB1ADRB2ADRB3CYP11B1DPP4FGFR1FGFR2FGFR3FGFR4HRH1JAK1JAK2JAK3KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITNAOPRD1OPRK1OPRM1PPDGFRBPIK3CDSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASMOTYK2polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
HRH1 known ✓ P35367 1/20 0.33
TSHR P16473 4/20 0.50
SLC22A16 Q86VW1 1/20 0.39
ALDH1A1 P00352 3/20 0.38
THRB P10828 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 3/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
GALR3 O60755 1/20 0.33
BLM P54132 1/20 0.33
LPAR1 Q92633 2/20 0.33
LPAR4 Q99677 2/20 0.33
LPAR2 Q9HBW0 2/20 0.33
LPAR3 Q9UBY5 2/20 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 SCHEMBL8763248 0.95 TSHR (0.49) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
SCHEMBL758619 0.91 TSHR (0.59) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Acetic Acid SCHEMBL22188618 0.90 TSHR (0.53) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Iodide SCHEMBL1255392 0.90 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Bromide SCHEMBL1254317 0.90 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Fluoride Ion SCHEMBL1254970 0.90 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Hydrochloric Acid SCHEMBL534137 0.90 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Hydrochloric Acid SCHEMBL204258 0.90 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Chloromethane SCHEMBL10796929 0.88 TSHR (0.55) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2
Methacrylic Acid SCHEMBL11703226 0.87 TSHR (0.50) TSHRSLC22A16ALDH1A1THRBSMN1; SMN2

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
EP-0783589-A1 TRANSPORTABILITY IMPROVER FOR PULVERIZED COAL Kao Corporation (JP) 1997-07-16 EP disclosed
WO-1996010093-A1 TRANSPORTABILITY IMPROVER FOR PULVERIZED COAL KAO CORPORATION (JP) 1996-04-04 WO disclosed