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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 20/20 | 0.69 |
| ▸ | PDE4A | P27815 | 19/20 | 0.69 |
| ▸ | PDE4C | Q08493 | 19/20 | 0.69 |
| ▸ | PDE4D | Q08499 | 19/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL3160937 | 0.86 | PDE4B (0.81) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL3160359 | 0.86 | PDE4B (0.69) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6546903 | 0.84 | PDE4B (0.76) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6546476 | 0.84 | PDE4B (0.76) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6546469 | 0.84 | PDE4B (0.76) | PDE4BPDE4APDE4CPDE4D | |
| Bicarbonate SCHEMBL3982339 | 0.83 | PDE4A (0.71) | PDE4BPDE4APDE4CPDE4D | |
| Bicarbonate SCHEMBL3981807 | 0.83 | PDE4A (0.74) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6820943 | 0.83 | PDE4B (0.66) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6545648 | 0.83 | PDE4B (0.66) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL6545650 | 0.83 | PDE4B (0.66) | PDE4BPDE4APDE4CPDE4D |
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-1308440-B1 | PIPERIDINE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO (JP) | 2009-05-06 | — | — | EP | claimed |