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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 14/20 | 0.37 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
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 SCHEMBL582582 | 0.98 | POLB (0.48) | POLBPDE4BPDE7AKMT2A | |
| SCHEMBL583461 | 0.94 | POLB (0.47) | POLBPDE4BPDE7AKMT2APDE3B | |
| Bicarbonate SCHEMBL583199 | 0.94 | POLB (0.51) | POLBPDE4BPDE7AKMT2APDE3B | |
| Bicarbonate SCHEMBL582209 | 0.94 | POLB (0.51) | POLBPDE4BPDE7AKMT2APDE3B | |
| Bicarbonate SCHEMBL583368 | 0.93 | POLB (0.50) | POLBPDE4BPDE7AKMT2APDE3B | |
| SCHEMBL582581 | 0.93 | POLB (0.49) | POLBPDE4BPDE7AKMT2A | |
| Bicarbonate SCHEMBL583813 | 0.93 | POLB (0.49) | POLBPDE4BPDE7AKMT2APIK3CD | |
| SCHEMBL582222 | 0.92 | POLB (0.45) | POLBPDE4BPDE7AKMT2A | |
| Bicarbonate SCHEMBL583789 | 0.92 | POLB (0.50) | POLBPDE4BPDE7AKMT2A | |
| Bicarbonate SCHEMBL583374 | 0.92 | POLB (0.50) | POLBPDE4BPDE7AKMT2A |
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-2124944-B1 | Pyrazolo[3,4-b]pyridine derivatives as phosphodiesterase inhibitors | RANBAXY LAB LTD (IN) | 2012-02-15 | — | — | EP | claimed |