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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 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 SCHEMBL8006134 | 0.83 | MAPT (0.33) | — | |
| Bicarbonate SCHEMBL8015336 | 0.82 | HPGD (0.32) | EPHX2 | |
| SCHEMBL8710393 | 0.80 | KDM4E (0.32) | — | |
| Bicarbonate SCHEMBL8019371 | 0.78 | EPHX2 (0.34) | EPHX2 | |
| Bicarbonate SCHEMBL8021766 | 0.77 | EPHX2 (0.34) | EPHX2 | |
| Bicarbonate SCHEMBL8018120 | 0.77 | TAS1R3 (0.34) | EPHX2 | |
| Bicarbonate SCHEMBL8022729 | 0.74 | EPHX2 (0.37) | EPHX2 | |
| Bicarbonate SCHEMBL8019312 | 0.74 | GRM1 (0.33) | EPHX2 | |
| Bicarbonate SCHEMBL8017378 | 0.74 | EPHX2 (0.40) | EPHX2 | |
| Bicarbonate SCHEMBL8022789 | 0.73 | EPHX2 (0.45) | EPHX2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0773920-B1 | 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES | BAYER AG (DE) | 2000-01-26 | — | — | EP | disclosed |
| EP-0773920-A1 | 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES | BAYER AG (DE) | 1997-05-21 | — | — | EP | disclosed |
| WO-1996003366-A1 | 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-02-08 | — | — | WO | disclosed |