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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL15899243 | 0.80 | ALDH1A1 (0.31) | TSHRALDH1A1TDP1 | |
| Bicarbonate SCHEMBL95313 | 0.77 | ALDH1A1 (0.35) | TSHRALDH1A1TDP1 | |
| Bicarbonate SCHEMBL1839991 | 0.77 | ALDH1A1 (0.35) | TSHRALDH1A1TDP1 | |
| Bicarbonate SCHEMBL1062002 | 0.77 | TSHR (0.31) | TSHR | |
| Bicarbonate SCHEMBL29117102 | 0.77 | TSHR (0.31) | TSHR | |
| SCHEMBL141788 | 0.76 | ALDH1A1 (0.43) | TSHRALDH1A1TDP1 | |
| SCHEMBL16542046 | 0.76 | ADORA3 (0.31) | — | |
| SCHEMBL11806205 | 0.75 | ALDH1A1 (0.45) | TSHRALDH1A1TDP1 | |
| SCHEMBL12319731 | 0.74 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL22035029 | 0.71 | LMNA (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120004371-A1 | CURABLE COMPOSITION | CEMEDINE CO., LTD. (JP) | 2012-01-05 | — | — | US | disclosed |