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.
Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL5670338 | 1.00 | ALDH1A1 (0.30) | ALDH1A1 | |
| Bicarbonate SCHEMBL9750468 | 0.74 | ALDH1A1 (0.37) | ALDH1A1 | |
| Bicarbonate SCHEMBL158037 | 0.74 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL93337 | 0.69 | ALDH1A1 (0.50) | ALDH1A1 | |
| Tert-Butyl Hydroperoxide SCHEMBL27609021 | 0.67 | ALDH1A1 (0.69) | ALDH1A1 | |
| Tert-Butyl Hydroperoxide SCHEMBL2671237 | 0.67 | ALDH1A1 (0.69) | ALDH1A1 | |
| Tert-Butyl Hydroperoxide SCHEMBL538709 | 0.67 | ALDH1A1 (0.69) | ALDH1A1 | |
| Tert-Butyl Hydroperoxide SCHEMBL28376532 | 0.64 | ALDH1A1 (0.64) | ALDH1A1 | |
| Bicarbonate SCHEMBL942694 | 0.63 | TSHR (0.33) | ALDH1A1 | |
| Bicarbonate SCHEMBL6903775 | 0.62 | CA1 (0.50) | ALDH1A1 |
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-5286796-A | Adding to polymerization mixture water insoluble partially saponified polyvinyl acetate | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1994-02-15 | — | — | US | disclosed |
| US-5157091-A | ULTRAVIOLET-ABSORBING POLYMER MATERIAL AND PHOTOETCHING PROCESS | MASATAKA MURAHARA (JP) | 1992-10-20 | — | — | US | disclosed |
| EP-0380667-A1 | ULTRAVIOLET-ABSORBING POLYMER MATERIAL AND PHOTOETCHING PROCESS | TERUMO KABUSHIKI KAISHA (JP) | 1990-08-08 | — | — | EP | disclosed |