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 | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.55 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL791816 | 0.92 | HRH1 (0.63) | HRH1PARP10ALDH1A1RAB9AEPHX2 | |
| SCHEMBL11792902 | 0.92 | HRH1 (0.63) | HRH1PARP10ALDH1A1RAB9AEPHX2 | |
| SCHEMBL1829827 | 0.89 | HRH1 (0.65) | HRH1PARP10ALDH1A1KAT6ASLC6A4 | |
| Phenol SCHEMBL28176906 | 0.86 | HRH1 (0.53) | HRH1PARP10ALDH1A1RAB9AEPHX2 | |
| SCHEMBL796490 | 0.85 | HRH1 (0.65) | HRH1PARP10SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL11503151 | 0.84 | HRH1 (0.55) | HRH1PARP10ALDH1A1SLC6A4SLC6A2 | |
| SCHEMBL28310871 | 0.84 | HRH1 (0.55) | HRH1PARP10ALDH1A1EPHX2FAAH | |
| Ammonia Solution, Strong SCHEMBL8081694 | 0.83 | HRH1 (0.63) | HRH1PARP10SLC6A4SLC6A2SLC6A3 | |
| Fluoride SCHEMBL28194548 | 0.83 | HRH1 (0.63) | HRH1PARP10SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL1817555 | 0.81 | EPHX2 (0.70) | PARP10ALDH1A1RAB9AEPHX2FAAH |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1597228-A2 | SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS | Sanofi-Aventis Deutschland GmbH (DE) | 2005-11-23 | — | — | EP | disclosed |
| WO-2004072025-A2 | SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2004-08-26 | — | — | WO | disclosed |