Bicarbonate

Bicarbonate

SCHEMBL4267974

CCCCc1ccccc1O.O=C(O)O

nearest known ligand 0.58

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 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.58
MCL1 Q07820 6/20 0.58
BCL2L1 Q07817 5/20 0.58
BAK1 Q16611 5/20 0.58
KAT8 Q9H7Z6 2/20 0.58
SAE1 Q9UBE0 2/20 0.58
PPARG P37231 1/20 0.58
PPARA Q07869 1/20 0.58
EP300 Q09472 1/20 0.58
KAT2A Q92830 1/20 0.58
KAT2B Q92831 1/20 0.58
KAT5 Q92993 1/20 0.58
AKR1B1 P15121 1/20 0.53
HTR1A P08908 1/20 0.53
TSHR P16473 1/20 0.53
TYR P14679 1/20 0.52
MMP2 P08253 2/20 0.50
F7 P08709 2/20 0.50
F3 P13726 2/20 0.50
KDM4E B2RXH2 1/20 0.50

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
Acetic Acid SCHEMBL9815548 0.94 BID (0.57) BIDMCL1BCL2L1BAK1KAT8
Benzene SCHEMBL9052791 0.94 HTR1A (0.58) BIDMCL1BCL2L1BAK1KAT8
Bicarbonate SCHEMBL9175297 0.93 BID (0.69) BIDMCL1BCL2L1BAK1KAT8
Bicarbonate SCHEMBL9170233 0.93 BID (0.69) BIDMCL1BCL2L1BAK1KAT8
Bicarbonate SCHEMBL4863706 0.93 BID (0.69) BIDMCL1BCL2L1BAK1KAT8
Propionic Acid SCHEMBL8222391 0.93 BID (0.55) BIDMCL1BCL2L1BAK1KAT8
Acetone SCHEMBL25277794 0.92 BID (0.54) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL29450060 0.92 HTR1A (0.60) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL20232 0.92 HTR1A (0.60) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9319489 0.92 HTR1A (0.60) BIDMCL1BCL2L1BAK1KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5322919-A Transesterification in an inert solvent IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1994-06-21 US claimed
EP-3692090-A1 IMPROVED METHOD OF MODIFYING A POLYCARBONATE DURING A MELT POLYMERIZATION SABIC Global Technologies B.V. (NL) 2020-08-12 EP disclosed
WO-2019069207-A1 IMPROVED METHOD OF MODIFYING A POLYCARBONATE DURING A MELT POLYMERIZATION SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2019-04-11 WO disclosed
EP-1760085-B1 PROCESS FOR PRODUCTION OF ALKYLTIN ALKOXIDES ASAHI KASEI CHEMICALS CORP (JP) 2014-02-26 EP disclosed
US-7541482-B2 Process for production of alkyltin alkoxides ASAHI KASEI CHEMICALS CORPORATION (JP) 2009-06-02 US disclosed
US-20080275262-A1 Process for Production of Alkyltin Alkoxides ASAHI KASEI CHEMICALS CORPORATION (JP) 2008-11-06 US disclosed
EP-1760085-A1 PROCESS FOR PRODUCTION OF ALKYLTIN ALKOXIDES Asahi Kasei Chemicals Corporation (JP) 2007-03-07 EP 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 (1 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-20080275262-A1 Process for Production of Alkyltin Alkoxides ALK, MOGAT2, SOAT2 BID 967/4885MCL1 344/4885BCL2L1 2692/4885

“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.