Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL5672061 | 0.87 | NPSR1 (0.52) | NPSR1L3MBTL1PKMALDH1A1RECQL | |
| Bromide SCHEMBL5146792 | 0.83 | NPSR1 (0.71) | NPSR1L3MBTL1ALDH1A1GLATSHR | |
| Bromide SCHEMBL7514295 | 0.82 | ALDH1A1 (0.76) | ALDH1A1RECQLGLATSHRCYP2D6 | |
| SCHEMBL21990759 | 0.81 | PKM (0.75) | PKMALDH1A1TSHRLMNAHTT | |
| SCHEMBL14621781 | 0.81 | NPSR1 (0.69) | NPSR1L3MBTL1ALDH1A1GLABCHE | |
| SCHEMBL125500 | 0.81 | NPSR1 (0.73) | NPSR1L3MBTL1ALDH1A1GLATSHR | |
| SCHEMBL30057272 | 0.81 | NPSR1 (0.73) | NPSR1L3MBTL1ALDH1A1GLATSHR | |
| Bromide SCHEMBL94168 | 0.81 | NPSR1 (0.64) | NPSR1L3MBTL1ALDH1A1BCHEACHE | |
| Hydrochloric Acid SCHEMBL2767719 | 0.80 | NPSR1 (0.68) | NPSR1L3MBTL1PKMALDH1A1GLA | |
| Bromide SCHEMBL3072258 | 0.80 | NPSR1 (0.94) | NPSR1L3MBTL1ALDH1A1BCHEACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0493671-B1 | Use of pyridinium salts for protecting plants against infestation by micro-organisms | BAYER AG (DE) | 1995-03-01 | — | — | EP | disclosed |
| EP-0493670-B1 | Agent for protecting plants against infestation by micro-organisms | BAYER AG (DE) | 1995-02-15 | — | — | EP | disclosed |
| EP-0493670-A1 | Agent for protecting plants against infestation by micro-organisms | BAYER AG (DE) | 1992-07-08 | — | — | EP | disclosed |
| EP-0493671-A1 | Use of pyridinium salts for protecting plants against infestation by micro-organisms | BAYER AG (DE) | 1992-07-08 | — | — | EP | disclosed |