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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | TAS1R3 | Q7RTX0 | 7/20 | 0.51 |
| ▸ | TAS1R1 | Q7RTX1 | 6/20 | 0.51 |
| ▸ | TAS1R2 | Q8TE23 | 6/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4170336 | 0.81 | TAS1R3 (0.67) | POLBTAS1R3TAS1R1TAS1R2CA1 | |
| SCHEMBL14893330 | 0.76 | POLB (0.53) | POLBTAS1R3TAS1R1TAS1R2HPGD | |
| SCHEMBL21593324 | 0.75 | POLB (0.51) | POLBTAS1R3TAS1R1TAS1R2HPGD | |
| SCHEMBL4159172 | 0.73 | TAS1R3 (0.79) | POLBTAS1R3TAS1R1TAS1R2CA1 | |
| SCHEMBL31290293 | 0.73 | TAS1R3 (0.73) | POLBTAS1R3TAS1R1TAS1R2CA1 | |
| SCHEMBL4170527 | 0.73 | TAS1R3 (0.62) | POLBTAS1R3TAS1R1TAS1R2NPC1 | |
| SCHEMBL4159246 | 0.72 | TAS1R3 (0.62) | TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL13927784 | 0.72 | TAS1R3 (0.80) | TAS1R3TAS1R1TAS1R2CA1CA2 | |
| SCHEMBL4260734 | 0.71 | SMYD3 (0.55) | — | |
| SCHEMBL4260732 | 0.71 | SMYD3 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997040007-A1 | 2,3,5,6-TETRAFLUOROBENZOIC ACID AMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-30 | — | — | WO | disclosed |