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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.60 |
| ▸ | TSHR | P16473 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | BRD4 | O60885 | 1/20 | 0.54 |
| ▸ | DAO | P14920 | 1/20 | 0.54 |
| ▸ | DDO | Q99489 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1263927 | 0.93 | KDM4E (0.66) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL31154599 | 0.93 | KDM4E (0.66) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL5678790 | 0.83 | MAPK1 (0.61) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL30434363 | 0.83 | MAPK1 (0.61) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL13349416 | 0.81 | KDM4E (0.59) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL6402311 | 0.81 | DAO (0.59) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL4437503 | 0.81 | MAPK1 (0.58) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL10102373 | 0.79 | GRM1 (0.55) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL9294138 | 0.78 | KDM4E (0.71) | MAPK1NPSR1KDM4ETSHRALDH1A1 | |
| SCHEMBL8306652 | 0.78 | KDM4E (0.59) | MAPK1NPSR1KDM4ETSHRALDH1A1 |
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-1003724-B1 | SUBSTITUTED QUINOLINE DERIVATIVES WITH ANTIVIRAL ACTION | AVENTIS PHARMA GMBH (DE) | 2003-02-12 | — | — | EP | disclosed |