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 | 3/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.49 |
| ▸ | PDE5A | O76074 | 1/20 | 0.48 |
| ▸ | PDE1A | P54750 | 1/20 | 0.48 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.48 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.46 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7353478 | 0.85 | ALDH1A1 (0.49) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| Bicarbonate SCHEMBL7764859 | 0.82 | HDAC3 (0.51) | KMT2APOLBPLAUITGB3ITGB1 | |
| SCHEMBL7765701 | 0.81 | ALDH1A1 (0.46) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7373335 | 0.79 | ITGB3 (0.71) | ALDH1A1MEN1KMT2APOLBCYP1A2 | |
| SCHEMBL7347314 | 0.79 | ALDH1A1 (0.45) | ALDH1A1PDE5APDE1APDE1BPDE1C | |
| SCHEMBL7458369 | 0.78 | ITGB3 (0.72) | ALDH1A1MEN1KMT2APOLBCYP1A2 | |
| SCHEMBL7572346 | 0.75 | ITGB3 (0.50) | ALDH1A1MEN1KMT2APOLBCYP1A2 | |
| SCHEMBL9303041 | 0.73 | PLAU (0.61) | MEN1KMT2AKCNK3KCNK9PLAU | |
| SCHEMBL9303751 | 0.72 | ITGB3 (0.62) | MEN1KMT2APOLBPLAUITGB3 | |
| Bicarbonate SCHEMBL7764864 | 0.72 | MEN1 (0.42) | MEN1KMT2AKCNK3KCNK9RAB9A |
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-0889875-B1 | CYCLOPROPYL ALKANOIC ACID DERIVATIVES | SEARLE & CO (US) | 2001-06-20 | — | — | EP | claimed |