Known targets — ChEMBL curated mechanism
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL7136582 | 1.00 | GABRR1 (0.42) | — | |
| Bicarbonate SCHEMBL7136153 | 1.00 | GABRR1 (0.42) | — | |
| Bicarbonate SCHEMBL8743136 | 0.96 | — | — | |
| Bicarbonate SCHEMBL578685 | 0.93 | — | — | |
| Cyclopentanamine SCHEMBL578697 | 0.89 | THRB (0.39) | — | |
| Bicarbonate SCHEMBL11593113 | 0.89 | PEPD (0.41) | — | |
| Oxalic Acid SCHEMBL27895423 | 0.88 | GABRR1 (0.40) | — | |
| Cyclohexylamine SCHEMBL578785 | 0.87 | CES2 (0.43) | — | |
| Cyclooctanamine SCHEMBL11193013 | 0.87 | CES2 (0.43) | — | |
| Cyclohexylamine SCHEMBL974340 | 0.87 | CES2 (0.43) | — |
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 67 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2836485-B1 | CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS | POLYPHOR AG (CH) | 2018-01-10 | — | — | EP | claimed |
| EP-1765408-B1 | POLYPEPTIDE PROTRACTING TAGS COMPRISING A TETRAZOLE MOIETY | NOVO NORDISK AS (DK) | 2015-12-09 | — | — | EP | claimed |
| EP-2289560-B1 | POLYPEPTIDE PROTRACTING TAGS COMPRISING A TETRAZOLE MOIETY | NOVO NORDISK AS (DK) | 2015-04-22 | — | — | EP | claimed |
| EP-2630124-B1 | TETRAHYDROQUINOLINE DERIVATIVES USED AS AMPK ACTIVATORS | HOFFMANN LA ROCHE (CH) | 2014-11-19 | — | — | EP | claimed |
| EP-2440516-B1 | 1-AMINOCYCLOPROPANE CARBOXYLIC ACID AS A FRUIT THINNER | VALENT BIOSCIENCES CORP (US) | 2014-03-05 | — | — | EP | claimed |
| EP-2231701-B1 | PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES | CADILA HEALTHCARE LTD (IN) | 2012-04-18 | — | — | EP | claimed |
| EP-1006122-B1 | PHENETHYLAMINE DERIVATIVES | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2008-12-03 | — | — | EP | claimed |
| EP-0533832-B1 | TREATMENT OF MOOD DISORDERS WITH FUNCTIONAL ANTAGONISTS OF THE GLYCINE/NMDA RECEPTOR COMPLEX | US SECRETARY UNITED STATES DEP (US) | 2002-11-20 | — | — | EP | claimed |
| EP-0678021-B1 | METHODS FOR THE IMPROVEMENT OF COGNITION WITH PARTIAL AGONISTS OF THE GLYCINE NMDA RECEPTOR COMPLEX | US GOV HEALTH & HUMAN SERV (US) | 2002-05-29 | — | — | EP | claimed |
| EP-0528970-B1 | METHODS AND COMPOSITIONS FOR MODULATING ETHYLENE LEVELS IN PLANT TISSUES | CALGENE LLC (US) | 1999-07-07 | — | — | EP | claimed |
| EP-0606881-B1 | Cyclic pentapeptides having a beta-turn and a gamma-turn | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-05-12 | — | — | EP | claimed |
| EP-0485431-B1 | PARTIAL AGONISTS OF THE STRYCHNINE INSENSITIVE GLYCINE MODULATORY SITE OF THE N-METHYL-D-ASPARTATE RECEPTOR COMPLEX AS NEUROPSYCHOPHARMACOLOGICAL AGENTS | US HEALTH (US) | 1997-02-19 | — | — | EP | claimed |
| EP-0025141-B1 | PROCESS FOR THE PRODUCTION OF 1-AMINO-CYCLOPROPANE-CARBOXYLIC ACID AND ITS DERIVATIVES | BAYER AG (DE) | 1982-05-12 | — | — | EP | claimed |
| EP-0025141-A1 | Process for the production of 1-amino-cyclopropane-carboxylic acid and its derivatives | BAYER AG (DE) | 1981-03-18 | — | — | EP | claimed |
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |
| EP-2387317-A2 | Fungicidal active agent compounds | Bayer CropScience AG (DE) | 2011-11-23 | — | — | EP | disclosed |
| US-D647068-S1 | Light-emitting diode | CITIZEN ELECTRONICS CO., LTD. (JP) | 2011-10-18 | — | — | US | disclosed |
| EP-0025141-A1 | Process for the production of 1-amino-cyclopropane-carboxylic acid and its derivatives | BAYER AG (DE) | 1981-03-18 | — | — | EP | disclosed |
| EP-0025141-A1 | Process for the production of 1-amino-cyclopropane-carboxylic acid and its derivatives | BAYER AG (DE) | 1981-03-18 | — | — | EP | disclosed |
| EP-0005782-A1 | Plant growth regulants and compositions containing them, their application and their preparation | BAYER AG (DE) | 1979-12-12 | — | — | EP | disclosed |