Bicarbonate

Bicarbonate

SCHEMBL4892629

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

nearest known ligand 0.57

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
TP53 P04637 1/20 0.57
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.40
FFAR3 O14843 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
SLC7A5 Q01650 1/20 0.37

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 SCHEMBL8964739 1.00 TP53 (0.57) TP53CA1CA2CA9ALDH1A1
Bicarbonate SCHEMBL27808902 0.87 TP53 (0.53) TP53CA1CA2CA9ALDH1A1
Acetic Acid SCHEMBL24229 0.87 FFAR3 (0.58) TP53ALDH1A1LMNATSHRFFAR3
Isopropyl Alcohol SCHEMBL3155394 0.86 TP53 (0.61) TP53CA1CA2CA9ALDH1A1
Isopropyl Alcohol SCHEMBL9737750 0.86
Isopropyl Alcohol SCHEMBL538205 0.86 TP53 (0.61) TP53CA1CA2CA9ALDH1A1
Bicarbonate SCHEMBL2159674 0.86
SCHEMBL27871931 0.84 TP53 (0.60) TP53ALDH1A1LMNATSHRSLC7A5
Isopropyl Alcohol SCHEMBL15251690 0.82 TP53 (0.57) TP53CA1CA2CA9ALDH1A1
Isopropyl Alcohol SCHEMBL28292853 0.82 TP53 (0.57) TP53CA1CA2CA9ALDH1A1

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 145 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117101717-A Catalyst for preparing carbonic acid-2, 3-butanediol ester and application thereof 抚顺东科新能源科技有限公司 2023-11-24 CN claimed
CN-116964143-A Additive for rubber composition and method for producing the same MCD技术有限公司 2023-10-27 CN claimed
CN-113429259-B Fluorine-containing compound and application thereof 中国科学院上海有机化学研究所 2023-03-24 CN claimed
CN-115335441-A Method for producing processed body having water repellent surface, and processed body having water repellent surface 古河电气工业株式会社 2022-11-11 CN claimed
CN-113429259-A Fluorine-containing compound and application thereof 中国科学院上海有机化学研究所 2021-09-24 CN claimed
US-11121406-B2 Electrolyte and battery CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2021-09-14 US claimed
US-10897063-B2 Electrolyte and electrochemical device CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2021-01-19 US claimed
US-10868334-B2 Electrolyte and electrochemical device CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2020-12-15 US claimed
EP-3557678-B1 ELECTROLYTE AND BATTERY CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2020-11-25 EP claimed
EP-3557681-B1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2020-05-13 EP claimed
US-20190326635-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2019-10-24 US claimed
US-20190326633-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2019-10-24 US claimed
US-20190326641-A1 ELECTROLYTE AND BATTERY CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2019-10-24 US claimed
EP-3557678-A1 ELECTROLYTE AND BATTERY Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP claimed
EP-3557681-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP claimed
EP-3557682-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP claimed
CN-107181001-A Electrolyte of lithium-ion secondary battery additive, electrolyte and its application 上海大学 2017-09-19 CN claimed
US-4082729-A PROCESS FOR THE PREPARATION OF OXYMETHYLENE POLYMERS HOECHST AKTIENGESELLSCHAFT (DT) 1978-04-04 US claimed
EP-4187650-B1 LITHIUM ION SECONDARY BATTERY, BATTERY CORE, NEGATIVE ELECTRODE PLATE, AND APPARATUS CONTEMPORARY AMPEREX TECHNOLOGY HONG KONG LTD (HK) 2026-04-15 EP disclosed
US-3948995-A Process for converting alkylaromatic hydroperoxides into phenolic products and carbonyl products RHONE-POULENC-TEXTILE (FR) 1976-04-06 US disclosed