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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | C3AR1 | Q16581 | 1/20 | 0.41 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.41 |
| ▸ | PTGES | O14684 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
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 SCHEMBL1079990 | 0.95 | BDKRB2 (0.43) | C3AR1BDKRB2TP53 | |
| SCHEMBL1179323 | 0.93 | CNR1 (0.39) | C3AR1BDKRB2PTGESMAOB | |
| Bicarbonate SCHEMBL3695270 | 0.91 | PTGES (0.41) | BDKRB2PTGESMAOB | |
| SCHEMBL1079989 | 0.89 | BDKRB2 (0.41) | BDKRB2MAOBTP53 | |
| SCHEMBL12872101 | 0.89 | BDKRB2 (0.41) | C3AR1BDKRB2PTGESTP53 | |
| SCHEMBL1177950 | 0.89 | PDE4A (0.40) | C3AR1PTGESMAOBHPGD | |
| Bicarbonate SCHEMBL3693843 | 0.89 | BDKRB2 (0.41) | C3AR1BDKRB2TP53 | |
| SCHEMBL1178266 | 0.88 | BDKRB2 (0.41) | BDKRB2PTGESTP53 | |
| SCHEMBL12871694 | 0.87 | BDKRB2 (0.40) | BDKRB2PTGESHPGDTP53 | |
| SCHEMBL1081746 | 0.87 | BDKRB2 (0.40) | BDKRB2 |
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-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |