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 SCHEMBL31403448 | 0.94 | CA4 (0.50) | — | |
| Bicarbonate SCHEMBL35076 | 0.94 | — | — | |
| Bicarbonate SCHEMBL14562504 | 0.88 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL843013 | 0.88 | — | — | |
| Bicarbonate SCHEMBL5967927 | 0.88 | — | — | |
| Bicarbonate SCHEMBL262245 | 0.88 | — | — | |
| Bicarbonate SCHEMBL14562512 | 0.88 | — | — | |
| Bicarbonate SCHEMBL3292663 | 0.88 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL5967928 | 0.88 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL31038671 | 0.88 | CA4 (0.46) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120097894-A1 | WHOLLY AROMATIC THERMOTROPIC LIQUID-CRYSTAL POLYESTER RESIN COMPOSITION, MOLDED OBJECT, AND LED REFLECTOR | JX NIPPON OIL & ENERGY CORPORATION (JP) | 2012-04-26 | — | — | US | disclosed |
| WO-2011146749-A2 | TESTING METHOD AND KIT FOR DETECTING LEAD, MERCURY AND CHROMATE IN PAINT, VARNISH AND OTHER SURFACE COATINGS | ESCA TECH, INC. (US) | 2011-11-24 | — | — | WO | disclosed |
| US-20110283785-A1 | Testing Method and Kit for Detecting Lead, Mercury, and Chromate in Paint , Varnish, and Other surface Coatings | ASKIN DANIEL P (US) | 2011-11-24 | — | — | US | disclosed |
| WO-2011033250-A1 | CURED MATERIALS AND METHOD OF MAKING SUCH MATERIALS | IMPERIAL INNOVATIONS GROUP PLC (GB) | 2011-03-24 | — | — | WO | disclosed |
| EP-2295387-A1 | Cured materals and method of making such materials | Imperial Innovations Ltd (GB) | 2011-03-16 | — | — | EP | disclosed |
| US-4474648-A | ELECTROLUTIC CELLS, QUANTITATIVE ANALYSIS | CITY TECHNOLOGY LIMITED (GB) | 1984-10-02 | — | — | US | disclosed |