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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.40 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL6993708 | 0.90 | GAA (0.44) | S1PR5KMT2ALMNAHPGD | |
| Bicarbonate SCHEMBL8744799 | 0.90 | KMT2A (0.49) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL6991552 | 0.87 | MEN1 (0.44) | EPHX1S1PR5KMT2AEPHX2 | |
| Bicarbonate SCHEMBL7615552 | 0.85 | EPHX2 (0.46) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL8744851 | 0.84 | TAS1R3 (0.56) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL7621065 | 0.84 | ALPL (0.47) | EPHX1ALPLS1PR5KMT2AEPHX2 | |
| Bicarbonate SCHEMBL8744732 | 0.83 | TAS1R3 (0.59) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL7615153 | 0.82 | KMT2A (0.42) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL7617866 | 0.81 | KMT2A (0.41) | KMT2ATAS1R3TAS1R1TAS1R2EPHX2 | |
| Bicarbonate SCHEMBL7614539 | 0.79 | KMT2A (0.46) | KMT2AEPHX2 |
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-0596298-B1 | 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides | BAYER AG (DE) | 2002-01-09 | — | — | EP | disclosed |
| EP-0596298-A2 | 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides | BAYER AG (DE) | 1994-05-11 | — | — | EP | disclosed |