Bicarbonate

Bicarbonate

SCHEMBL5535181

O=C([O-])[O-].O=C([O-])[O-].[Cs+].[Cs+].[K+].[K+]

nearest known ligand 0.60

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 12)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.60
FAHD1 Q6P587 1/20 0.60
MEN1 O00255 1/20 0.46
LDHA P00338 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
CA1 P00915 3/20 0.46
LMNA P02545 2/20 0.36
CASP1 P29466 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 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
Bicarbonate SCHEMBL23702350 1.00
Bicarbonate SCHEMBL23525300 0.94
Bicarbonate SCHEMBL28420909 0.94 CA4 (0.67) CA4FAHD1MEN1LDHABLM
Bicarbonate SCHEMBL2351948 0.94 CA4 (0.67) CA4FAHD1MEN1LDHABLM
Bicarbonate SCHEMBL1332143 0.94
Bicarbonate SCHEMBL1930 0.94
Bicarbonate SCHEMBL1697622 0.94 CA4 (0.50) CA4FAHD1MEN1LDHABLM
Bicarbonate SCHEMBL852 0.94
Bicarbonate SCHEMBL2275798 0.94 CA4 (0.67) CA4FAHD1MEN1LDHABLM
Bicarbonate SCHEMBL2560104 0.89 CA4 (0.50) CA4FAHD1MEN1LDHABLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2023-12-05 US disclosed
CN-113683629-B Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2023-07-04 CN disclosed
US-20210130317-A1 Compounds Useful as Inhibitors of Isoprenylcysteine Carboxyl Methyltransferase AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2021-05-06 US disclosed
EP-3681878-A1 COMPOUNDS USEFUL AS INHIBITORS OF ISOPRENYLCYSTEINE CARBOXYL METHYLTRANSFERASE Agency for Science, Technology and Research (SG) 2020-07-22 EP disclosed
WO-2019054944-A1 COMPOUNDS USEFUL AS INHIBITORS OF ISOPRENYLCYSTEINE CARBOXYL METHYLTRANSFERASE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2019-03-21 WO disclosed
EP-3209669-A1 SUBSTITUTED 1,2,3-TRIAZOL-1-YL-METHYL-2,3-DIHYDRO-2-METHYL-6-NITROIMIDAZO[2,1-B]OXAZOLES AS ANTI-MYCOBACTERIAL AGENTS AND A PROCESS FOR THE PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2017-08-30 EP disclosed
US-20170008886-A1 A PROCESS FOR THE PREPARATION OF APIXABAN AND ITS INTERMEDIATES WANBURY LTD. (IN) 2017-01-12 US disclosed
EP-3097100-A2 A PROCESS FOR THE PREPARATION OF APIXABAN AND ITS INTERMEDIATES Wanbury Limited (IN) 2016-11-30 EP disclosed
WO-2015111073-A2 A PROCESS FOR THE PREPARATION OF APIXABAN AND ITS INTERMEDIATES WANBURY LTD. (IN) 2015-07-30 WO disclosed
US-20070105904-A1 3-(3-(4-(pyridin-2-yloxymethyl)-benzyl)-isoxazol-5-yl)-pyridin-2-ylamine; inhibiting fungal GPI biosynthesis thereby inhibiting expression of cell wall proteins and blocking cell wall assembly while preventing the fungus from attaching to cells EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-05-10 US disclosed
CN-1518534-A Copper-catalyzed carbon-heteroatom and carbon-carbon bond formation 麻省理工学院 2004-08-04 CN 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-20210130317-A1 Compounds Useful as Inhibitors of Isoprenylcysteine Carboxyl Methyltransferase ICMT, INMT, BHMT CA4 1764/4885FAHD1 452/4885MEN1 200/4885
US-11834430-B2 Compounds useful as inhibitors of isoprenylcysteine carboxyl methyltransferase ICMT, INMT, BHMT CA4 1764/4885FAHD1 452/4885MEN1 200/4885
US-20070105904-A1 3-(3-(4-(pyridin-2-yloxymethyl)-benzyl)-isoxazol-5-yl)-pyridin-2-ylamine; inhibiting fungal GPI biosynthesis thereby inhibiting expression of cell wall proteins and blocking cell wall assembly while preventing the fungus from attaching to cells GPI, ERG28, MAN2A1 CA4 3578/4885FAHD1 4883/4885MEN1 2913/4885
US-20170008886-A1 A PROCESS FOR THE PREPARATION OF APIXABAN AND ITS INTERMEDIATES VKORC1, VKORC1L1, F11 CA4 679/4885FAHD1 2155/4885MEN1 2645/4885

“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.