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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 11/20 | 0.65 |
| ▸ | PPARA | Q07869 | 10/20 | 0.65 |
| ▸ | PPARG | P37231 | 7/20 | 0.65 |
| ▸ | FFAR1 | O14842 | 10/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 SCHEMBL4673788 | 0.96 | PPARD (0.67) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL4674389 | 0.89 | PPARD (0.61) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL4677282 | 0.85 | PPARD (0.56) | PPARDPPARAPPARGFFAR1 | |
| SCHEMBL4673783 | 0.84 | FFAR1 (0.71) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL6235596 | 0.82 | PPARD (0.72) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL4674102 | 0.82 | PPARD (0.72) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL3519570 | 0.81 | PPARD (0.69) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL4676325 | 0.80 | PPARD (0.64) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL6618532 | 0.80 | PPARD (0.61) | PPARDPPARAPPARGFFAR1MEN1 | |
| SCHEMBL4674174 | 0.80 | PPARD (0.66) | PPARDPPARAPPARGFFAR1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1482935-B1 | THIAZOLE AND OXAZOLE DERIVATIVES WHICH MODULATE PPAR ACTIVITY | WARNER LAMBERT CO (US) | 2008-08-20 | — | — | EP | claimed |