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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL28575017 | 0.95 | TDP1 (0.47) | TDP1TP53ALDH1A1GAA | |
| Bicarbonate SCHEMBL8871100 | 0.83 | TDP1 (0.61) | TDP1TP53ALDH1A1GAA | |
| Bicarbonate SCHEMBL20542224 | 0.80 | TDP1 (0.57) | TDP1TP53ALDH1A1GAA | |
| Acetic Acid SCHEMBL29169948 | 0.77 | TDP1 (0.53) | TDP1TP53ALDH1A1GAA | |
| SCHEMBL23884959 | 0.74 | TP53 (0.39) | TP53ALDH1A1 | |
| Oxalic Acid SCHEMBL21145225 | 0.74 | TDP1 (0.57) | TDP1TP53ALDH1A1GAA | |
| Oxalic Acid SCHEMBL21145223 | 0.74 | TDP1 (0.57) | TDP1TP53ALDH1A1GAA | |
| Acetic Acid SCHEMBL1114492 | 0.74 | TDP1 (0.57) | TDP1TP53ALDH1A1GAA | |
| Acetic Acid SCHEMBL29173803 | 0.74 | TDP1 (0.57) | TDP1TP53ALDH1A1GAA | |
| Hydrogen Peroxide SCHEMBL135019 | 0.72 | — | — |
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-2539144-A1 | COMPOSITE FOAM PRODUCT | Vertex L.L.C. (US) | 2013-01-02 | — | — | EP | disclosed |
| WO-2011102954-A1 | COMPOSITE FOAM PRODUCT | VERTEX L.L.C. (US) | 2011-08-25 | — | — | WO | disclosed |