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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 SCHEMBL1834590 | 1.00 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Oxalic Acid SCHEMBL1835274 | 0.92 | SMN1; SMN2 (0.33) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Oxalic Acid SCHEMBL1835265 | 0.92 | SMN1; SMN2 (0.33) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Acetic Acid SCHEMBL1838385 | 0.92 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Lactic Acid SCHEMBL1833812 | 0.87 | TP53 (0.55) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Pyruvate SCHEMBL1832070 | 0.87 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2SLC1A3SLC1A2SLC1A1 | |
| Bicarbonate SCHEMBL1831704 | 0.87 | SMN1; SMN2 (0.31) | ALDH1A1SMN1; SMN2SLC1A3SLC1A2SLC1A1 | |
| Cadaverine Tartrate SCHEMBL1830019 | 0.85 | TSHR (0.48) | ALDH1A1SMN1; SMN2TP53SLC1A3SLC1A2 | |
| Fumaric Acid SCHEMBL1833868 | 0.85 | HCAR2 (0.52) | ALDH1A1SMN1; SMN2TP53HCAR2KEAP1 | |
| Succinic Acid SCHEMBL1833033 | 0.85 | EGLN1 (0.43) | ALDH1A1TSHR |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070185330-A1 | Liquids | THE UNIVERSITY OF YORK (GB) | 2007-08-09 | — | — | US | claimed |
| US-9328220-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2016-05-03 | — | — | US | disclosed |
| US-8992798-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2015-03-31 | — | — | US | disclosed |
| US-8784686-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2014-07-22 | — | — | US | disclosed |
| US-20140187684-A1 | LIQUIDS | INNOVIA FILMS LIMITED (GB) | 2014-07-03 | — | — | US | disclosed |
| US-20110257433-A1 | LIQUIDS | THE UNIVERSITY OF YORK (GB) | 2011-10-20 | — | — | US | disclosed |
| EP-2322497-A1 | Ionic liquids comprising nitrogen containing cations | Innovia Films Limited (GB) | 2011-05-18 | — | — | EP | disclosed |
| US-20080221361-A1 | Ionic Liquids | BIONIQS LIMITED (GB) | 2008-09-11 | — | — | US | disclosed |
| US-20070185330-A1 | Liquids | THE UNIVERSITY OF YORK (GB) | 2007-08-09 | — | — | US | disclosed |