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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 5/20 | 0.39 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
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 SCHEMBL28196580 | 0.90 | CA1 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL2058500 | 0.90 | — | — | |
| Bicarbonate SCHEMBL3623405 | 0.90 | CA1 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL17888738 | 0.90 | CA1 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL225640 | 0.90 | CA4 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL15794084 | 0.90 | CA4 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL6032220 | 0.90 | CA4 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL4839463 | 0.90 | CA1 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL3397287 | 0.90 | CA4 (0.50) | CA1CA2CA9CA4FAHD1 | |
| Bicarbonate SCHEMBL28136051 | 0.90 | CA1 (0.50) | CA1CA2CA9CA4FAHD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0968270-A1 | TRANSITION METAL COMPLEX-CONTAINING SYSTEMS AS ACTIVATORS FOR PEROXIDE COMPOUNDS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2000-01-05 | — | — | EP | disclosed |
| WO-1997036987-A1 | TRANSITION METAL COMPLEX-CONTAINING SYSTEMS AS ACTIVATORS FOR PEROXIDE COMPOUNDS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1997-10-09 | — | — | WO | disclosed |