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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30951068 | 0.79 | CYP1A2 (0.42) | CHRM2CYP1A2CYP2C9CYP2C19 | |
| Bromide SCHEMBL6537215 | 0.79 | MEN1 (0.41) | ALDH1A1 | |
| SCHEMBL7750107 | 0.79 | MAPT (0.46) | CYP2C19 | |
| SCHEMBL1656985 | 0.78 | MEN1 (0.42) | — | |
| SCHEMBL5271474 | 0.77 | MEN1 (0.41) | — | |
| SCHEMBL30148940 | 0.77 | MEN1 (0.41) | — | |
| SCHEMBL3859355 | 0.77 | MEN1 (0.41) | — | |
| SCHEMBL5271477 | 0.77 | MEN1 (0.41) | — | |
| SCHEMBL721215 | 0.77 | MEN1 (0.41) | — | |
| SCHEMBL178274 | 0.77 | ALOX15 (0.39) | MAPK1ALDH1A1GAAPKM |
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 |
|---|---|---|---|---|---|---|---|
| US-6828116-B1 | Energy transfer assay method and reagent | AMERSHAM BIOSCIENCES UK LIMITED (GB) | 2004-12-07 | — | — | US | disclosed |
| EP-1086179-B1 | ENERGY TRANSFER ASSAY METHOD AND REAGENT | AMERSHAM BIOSCIENCES UK LTD (GB) | 2003-04-23 | — | — | EP | disclosed |
| EP-1086179-A1 | ENERGY TRANSFER ASSAY METHOD AND REAGENT | Amersham Pharmacia Biotech UK Ltd. (GB) | 2001-03-28 | — | — | EP | disclosed |
| WO-1999064519-A1 | ENERGY TRANSFER ASSAY METHOD AND REAGENT | AMERSHAM BIOSCIENCES CORP (GB) | 1999-12-16 | — | — | WO | disclosed |