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 | |
|---|---|---|---|---|
| Peroxynitrite SCHEMBL30148125 | 0.91 | — | — | |
| Peroxynitrite SCHEMBL15117 | 0.87 | — | — | |
| Peroxynitrite SCHEMBL6851573 | 0.87 | — | — | |
| Peroxynitrite SCHEMBL17180226 | 0.82 | — | — | |
| Peroxynitrite SCHEMBL28863409 | 0.82 | — | — | |
| Peroxynitrite SCHEMBL14964652 | 0.82 | — | — | |
| Peroxynitrite SCHEMBL28447690 | 0.82 | — | — | |
| Peroxynitrite SCHEMBL1324560 | 0.78 | — | — | |
| Peroxynitrite SCHEMBL27699043 | 0.78 | — | — | |
| Peroxynitrite SCHEMBL28300144 | 0.78 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150174144-A1 | TETRACYCLINE COMPOUNDS FOR TREATING NEURODEGENERATIVE DISORDERS | PARATEK PHARMACEUTICALS, INC. | 2015-06-25 | — | — | US | disclosed |
| EP-2872146-A2 | TETRACYCLINE COMPOUNDS FOR TREATING NEURODEGENERATIVE DISORDERS | Paratek Pharmaceuticals, Inc. (US) | 2015-05-20 | — | — | EP | disclosed |
| WO-2014012094-A2 | TETRACYCLINE COMPOUNDS FOR TREATING NEURODEGENERATIVE DISORDERS | PARATEK PHARMACEUTICALS, INC. (US) | 2014-01-16 | — | — | WO | disclosed |