Bicarbonate

Bicarbonate

SCHEMBL10338751

CC(C)(C)COO.CC(C)(C)COO.O=C(O)O.O=C(O)O

nearest known ligand 0.38

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 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.38
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
CYP2D6 P10635 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL3710599 0.87
Bicarbonate SCHEMBL28022646 0.79 CYP2C19 (0.39) CYP2C19TSHRALDH1A1HMGCRCHRM1
Bicarbonate SCHEMBL29015753 0.79 CYP2C19 (0.39) CYP2C19TSHRALDH1A1HMGCRCHRM1
Tert-Butyl Hydroperoxide SCHEMBL25265357 0.76 ALDH1A1 (0.45) CYP2C19ALDH1A1
SCHEMBL10949591 0.74
SCHEMBL1462566 0.71
SCHEMBL320683 0.71
Acetic Acid SCHEMBL7488788 0.71 FFAR3 (0.41) CYP2C19TSHRALDH1A1HMGCRCHRM1
Bicarbonate SCHEMBL4119077 0.67 ALDH1A1 (0.44) TSHRALDH1A1CYP2D6
Tert-Butyl Hydroperoxide SCHEMBL538709 0.67 ALDH1A1 (0.69) CYP2C19TSHRALDH1A1HMGCRCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200388880-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE ADDITIVE COMPOUNDS ENEVATE CORPORATION 2020-12-10 US claimed
JP-2110110-A None JP disclosed
US-11742519-B2 Silicon-based energy storage devices with electrolyte additive compounds ENEVATE CORPORATION (US) 2023-08-29 US disclosed
US-20200388880-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE ADDITIVE COMPOUNDS ENEVATE CORPORATION 2020-12-10 US disclosed
JP-H02110110-A POLYMERIZATION OR COPOLYMERIZATION OF ALKYLENE GLYCOL BIS(ALLYLCARBONATE) SANKEN KAKO KK 1990-04-23 JP 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 (2 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-20200388880-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE ADDITIVE COMPOUNDS SOST, CA1, DUOX2 CYP2C19 2401/4885TSHR 4386/4885ALDH1A1 1727/4885
US-11742519-B2 Silicon-based energy storage devices with electrolyte additive compounds SOST, CA1, DUOX2 CYP2C19 2401/4885TSHR 4386/4885ALDH1A1 1727/4885

“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.