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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.44 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.44 |
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | CLPP | Q16740 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
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 SCHEMBL8901003 | 1.00 | SIGMAR1 (0.50) | SIGMAR1CMA1PKMKMT2ACHRM2 | |
| Bromide SCHEMBL8567147 | 0.87 | SIGMAR1 (0.47) | SIGMAR1KMT2AMEN1 | |
| Bromide SCHEMBL8899316 | 0.87 | SIGMAR1 (0.47) | SIGMAR1KMT2AMEN1 | |
| Bromide SCHEMBL8563399 | 0.84 | HDAC1 (0.43) | KMT2AMEN1ALDH1A1HDAC1HDAC8 | |
| Bromide SCHEMBL8563395 | 0.84 | HDAC1 (0.43) | KMT2AMEN1ALDH1A1HDAC1HDAC8 | |
| Bromide SCHEMBL8560227 | 0.83 | APP (0.38) | KMT2AMEN1KDM4E | |
| Bromide SCHEMBL8900274 | 0.83 | APP (0.38) | KMT2AMEN1KDM4E | |
| Bromide SCHEMBL8599535 | 0.83 | ALDH1A1 (0.44) | SIGMAR1PKMKMT2ACHRM2CHRM3 | |
| Bromide SCHEMBL8900350 | 0.83 | ALDH1A1 (0.44) | SIGMAR1PKMKMT2ACHRM2CHRM3 | |
| Bromide SCHEMBL26663611 | 0.83 | BTK (0.46) | KMT2AMEN1KDM4EALDH1A1MAPT |
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 |