Bicarbonate

Bicarbonate

SCHEMBL3824855

O=C([O-])O.O=S([O-])[O-].[Na+].[Na+].[Na+]

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA4 P22748 4/20 0.43
FAHD1 Q6P587 1/20 0.43
CA1 P00915 3/20 0.40
MEN1 O00255 1/20 0.35
LDHA P00338 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.33
CASP1 P29466 1/20 0.33
CA2 P00918 2/20 0.32
CA9 Q16790 1/20 0.31

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
Bicarbonate SCHEMBL29273171 0.93 CA1 (0.43) CA4FAHD1CA1MEN1LDHA
Bicarbonate SCHEMBL226679 0.88 CA4 (0.40) CA4FAHD1CA1MEN1LDHA
Bicarbonate SCHEMBL3326642 0.87 CA4 (0.46) CA4FAHD1CA1MEN1LDHA
Bicarbonate SCHEMBL5912779 0.87 CA1 (0.46) CA4FAHD1CA1CA2CA9
Sulfurous Acid SCHEMBL11718648 0.87
Bicarbonate SCHEMBL10755209 0.83
Oxalic Acid SCHEMBL28071621 0.83 OR51E2 (0.33) CA4FAHD1CA1LDHACA2
Bicarbonate SCHEMBL28179570 0.82
Bicarbonate SCHEMBL6566883 0.82 CA4 (0.35) CA4FAHD1CA1MEN1LDHA
Bicarbonate SCHEMBL1332636 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-04-27 US disclosed
EP-3394066-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS H. Hoffnabb-La Roche Ag (CH) 2018-10-31 EP disclosed
US-20180298015-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS GENENTECH, INC. (US) 2018-10-18 US disclosed
WO-2017108723-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2017-06-29 WO disclosed
EP-1699291-B1 PLANT GROWTH REGULATION BAYER CROPSCIENCE AG (DE) 2009-09-02 EP disclosed
US-7569516-B2 Plant growth regulation BAYER CROPSCIENCE AG (DE) 2009-08-04 US disclosed
US-20070149406-A1 Plant growth regulation BAYER CROPSCIENCE GMBH (DE) 2007-06-28 US disclosed
CN-1938323-A Silinane compounds as cysteine protease inhibitors SCHERING AG (DE) 2007-03-28 CN disclosed
EP-1699291-A1 PLANT GROWTH REGULATION Bayer CropScience GmbH (DE) 2006-09-13 EP disclosed
WO-2005063020-A1 PLANT GROWTH REGULATION BAYER CROPSCIENCE GMBH (DE) 2005-07-14 WO disclosed
EP-1550370-A1 Plant growth regulation Bayer CropScience GmbH (DE) 2005-07-06 EP disclosed
EP-1028955-B1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 2003-07-16 EP disclosed
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them HICKEY DEIRDRE MARY BERNADETTE (GB) 2002-08-29 US disclosed
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 US disclosed
EP-1028955-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SmithKline Beecham p.l.c. (GB) 2000-08-23 EP disclosed
WO-1999024420-A1 PYRIMIDINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM PLC (GB) 1999-05-20 WO disclosed
US-5225422-A Antiallergens, antiinflammatory agents SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1993-07-06 US disclosed
EP-0516069-A1 Leukotriene B4 antagonist SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-12-02 EP disclosed
US-5112855-A Nootropic Agents CIBA-GEIGY CORPORATION (US) 1992-05-12 US disclosed
US-4957928-A NOOTROPIC AGENTS, COGNITION ACTIVATORS CIBA-GEIGY CORPORATION (US) 1990-09-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020120139-A1 Pyrimidinone compounds and pharmaceutical compositions containing them PLA2G7, PLA2G1B, PLA2G4C CA4 4756/4885FAHD1 868/4885CA1 4810/4885
US-20180298015-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS IRAK1, IRAK4, IRAK2 CA4 4636/4885FAHD1 1222/4885CA1 4860/4885
US-20070149406-A1 Plant growth regulation GHDC, GTF2I, GHITM CA4 2784/4885FAHD1 4578/4885CA1 4564/4885
US-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators IRAK1, IRAK4, IRAK2 CA4 4636/4885FAHD1 1222/4885CA1 4860/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.