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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 8/20 | 0.54 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 SCHEMBL9003366 | 0.97 | BBOX1 (0.52) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL4444511 | 0.90 | BBOX1 (0.52) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Acetic Acid SCHEMBL5844598 | 0.90 | BBOX1 (0.52) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Oxalic Acid SCHEMBL1051688 | 0.90 | BBOX1 (0.52) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Oxalic Acid SCHEMBL30381501 | 0.90 | BBOX1 (0.52) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Propionic Acid SCHEMBL11436115 | 0.88 | BBOX1 (0.56) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Oxalic Acid SCHEMBL1051691 | 0.85 | BBOX1 (0.48) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Oxalic Acid SCHEMBL17311834 | 0.83 | BBOX1 (0.46) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| SCHEMBL10641701 | 0.83 | BBOX1 (0.46) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL4444509 | 0.83 | BBOX1 (0.44) | BBOX1FFAR3HDAC3HDAC1HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0839841-B1 | Anti-bacterial water absorbing agent and anti-bacterial water absorbent material | SANYO CHEMICAL IND LTD (JP) | 2009-05-06 | — | — | EP | disclosed |
| US-5981668-A | COMPRISING A WATER ABSORBING RESIN HAVING PENDANT ACID GROUPS, AT LEAST ONE ACID GROUP BEING IN THE FORM OF A QUATERNARY AMMONIUM SALT | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1999-11-09 | — | — | US | disclosed |
| EP-0839841-A2 | Anti-bacterial water absorbing agent and anti-bacterial water absorbent material | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 1998-05-06 | — | — | EP | disclosed |