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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 1/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5146792 | 0.84 | NPSR1 (0.71) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| Hydrochloric Acid SCHEMBL34474903 | 0.84 | NPSR1 (0.62) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| SCHEMBL13934015 | 0.84 | ALDH1A1 (0.73) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| Hydrochloric Acid SCHEMBL3074465 | 0.84 | NPSR1 (0.62) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| Bromide SCHEMBL9554747 | 0.83 | BCHE (0.70) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| SCHEMBL125500 | 0.82 | NPSR1 (0.73) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| SCHEMBL30057272 | 0.82 | NPSR1 (0.73) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| Bromide SCHEMBL3072258 | 0.81 | NPSR1 (0.94) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| SCHEMBL124203 | 0.81 | NPSR1 (0.71) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE | |
| Fluoride Ion SCHEMBL5148095 | 0.81 | NPSR1 (0.71) | NPSR1L3MBTL1ALDH1A1CYP2D6BCHE |
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-2425878-A1 | Protective coating compostition | Nederlandse Organisatie voor toegepast -natuurwetenschappelijk onderzoek TNO (NL) | 2012-03-07 | — | — | EP | disclosed |