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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28189764 | 0.80 | SMN1; SMN2 (0.49) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL12583561 | 0.79 | SMN1; SMN2 (0.47) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL4396691 | 0.78 | SMN1; SMN2 (0.55) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL4396692 | 0.78 | SMN1; SMN2 (0.55) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL28883048 | 0.78 | CYP3A4 (0.51) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4398174 | 0.77 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL9551389 | 0.77 | HTT (0.54) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL14498573 | 0.77 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL4398176 | 0.77 | SMN1; SMN2 (0.53) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL9551388 | 0.77 | HTT (0.54) | ALDH1A1CYP3A4CYP2C19CYP2C9SMN1; SMN2 |
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-1651653-B1 | NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT | SANOFI AVENTIS DEUTSCHLAND (DE) | 2011-11-23 | — | — | EP | disclosed |
| EP-1651653-A1 | NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT | Sanofi-Aventis Deutschland GmbH (DE) | 2006-05-03 | — | — | EP | disclosed |
| WO-2005012312-A1 | NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2005-02-10 | — | — | WO | disclosed |