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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 6/20 | 0.58 |
| ▸ | CTSK | P43235 | 5/20 | 0.58 |
| ▸ | ACE | P12821 | 3/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.49 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 3/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | CPA1 | P15085 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1691095 | 0.89 | ACE (0.60) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL2721558 | 0.89 | ACE (0.60) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL231980 | 0.86 | CTSS (0.71) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL231981 | 0.86 | CTSS (0.71) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL1310547 | 0.86 | CTSS (0.71) | CTSSCTSKACEITGB3ITGA2B | |
| Benzene SCHEMBL6474758 | 0.85 | CTSS (0.70) | CTSSCTSKACEITGB3ITGA2B | |
| Benzene SCHEMBL3925161 | 0.85 | CTSS (0.70) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL28630396 | 0.82 | CTSS (0.72) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL7656189 | 0.79 | PPARA (0.69) | CTSSCTSKACEITGB3ITGA2B | |
| SCHEMBL28486021 | 0.79 | CTSS (0.61) | CTSSCTSKACEITGB3ITGA2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2089052-A1 | PEG LINKER COMPOUNDS AND BIOLOGICALLY ACTIVE CONJUGATES THEREOF | Peg Biosciences (US) | 2009-08-19 | — | — | EP | disclosed |
| WO-2007140282-A1 | PEG LINKER COMPOUNDS AND BIOLOGICALLY ACTIVE CONJUGATES THEREOF | PEG BIOSCIENCES (US) | 2007-12-06 | — | — | WO | disclosed |