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 | 0.36 |
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.36 |
| ▸ | FADS1 | O60427 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8900459 | 1.00 | FADS1 (0.39) | FADS1HTR2CPOLBDRD2DRD3 | |
| Bromide SCHEMBL7880298 | 0.86 | MEN1 (0.43) | POLBMGLLROCK2 | |
| Bromide SCHEMBL7880295 | 0.86 | MEN1 (0.43) | POLBMGLLROCK2 | |
| Bromide SCHEMBL8565678 | 0.84 | CA12 (0.47) | POLBDRD2DRD3ALDH1A1ALOX5 | |
| Bromide SCHEMBL8898039 | 0.84 | CA12 (0.47) | POLBDRD2DRD3ALDH1A1ALOX5 | |
| Bromide SCHEMBL8897811 | 0.82 | MAPT (0.49) | DRD2DRD3MGLLALDH1A1ROCK2 | |
| Bromide SCHEMBL8563694 | 0.82 | MAPT (0.49) | DRD2DRD3MGLLALDH1A1ROCK2 | |
| Bromide SCHEMBL8900400 | 0.81 | MAPT (0.43) | POLBALDH1A1GFERLMNA | |
| Bromide SCHEMBL7889686 | 0.81 | MAPT (0.43) | POLBALDH1A1GFERLMNA | |
| Bromide SCHEMBL8567118 | 0.81 | SLC6A2 (0.47) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5804577-A | ANTIBIOTICS | HOFFMANN-LA ROCHE INC. (US) | 1998-09-08 | — | — | US | disclosed |
| EP-0761673-A1 | Cephalosporin derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1997-03-12 | — | — | EP | disclosed |