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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.52 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31501304 | 0.86 | NAAA (0.58) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL31501321 | 0.85 | NAAA (0.61) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL31501308 | 0.83 | NAAA (0.64) | HDAC6HDAC8NAAAEPHX1KEAP1 | |
| SCHEMBL31501326 | 0.83 | NAAA (0.64) | HDAC6HDAC8NAAAEPHX1KEAP1 | |
| Bicarbonate SCHEMBL7274197 | 0.82 | HDAC6 (0.55) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL9951287 | 0.82 | NAAA (0.56) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL3199790 | 0.82 | NAAA (0.56) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL19359643 | 0.82 | NAAA (0.56) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL5901310 | 0.82 | NAAA (0.56) | HDAC6HDAC8NAAAEPHX1SMN1; SMN2 | |
| SCHEMBL3199095 | 0.80 | NAAA (0.53) | NAAAEPHX1SMN1; SMN2NPC1PKM |
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-0337348-B1 | Amides of cyclomethylen-1,2-bicarboxylic acids having therapeutical activity, processes for their preparation and pharmaceutical compositions containing them | GUIDOTTI & C SPA LABOR (IT) | 1994-02-02 | — | — | EP | claimed |