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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 6/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 6/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 6/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25739754 | 0.90 | ALDH1A1 (0.38) | LMNANPSR1ALDH1A1 | |
| SCHEMBL19335820 | 0.81 | — | — | |
| SCHEMBL9406589 | 0.81 | PLG (0.48) | LMNASLC1A3SLC1A2SLC1A1ALDH1A1 | |
| SCHEMBL9647114 | 0.81 | PLG (0.48) | LMNASLC1A3SLC1A2SLC1A1ALDH1A1 | |
| SCHEMBL9647118 | 0.81 | PLG (0.48) | LMNASLC1A3SLC1A2SLC1A1ALDH1A1 | |
| Bicarbonate SCHEMBL9115339 | 0.78 | HSD11B1 (0.36) | LMNAHSD11B1ALDH1A1 | |
| Carbamic Acid SCHEMBL21555693 | 0.78 | SLC1A3 (0.46) | LMNANPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL16471050 | 0.77 | LMNA (0.44) | LMNANPSR1SLC1A3SLC1A2SLC1A1 | |
| Methyl Alcohol SCHEMBL10396919 | 0.77 | LMNA (0.41) | LMNANPSR1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL11224706 | 0.76 | CYP1A2 (0.40) | LMNANPSR1SLC1A3SLC1A2SLC1A1 |
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-0355552-B1 | Alkoxymethyl- and alkenyloxymethyl-cyclohexanes | HOFFMANN LA ROCHE (CH) | 1994-02-23 | — | — | EP | disclosed |