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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | LIPE | Q05469 | 1/20 | 0.34 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.34 |
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 SCHEMBL8898969 | 1.00 | KMT2A (0.38) | KMT2AGPR119USP30MAPTMCHR1 | |
| Bromide SCHEMBL7885612 | 0.90 | LIPE (0.41) | KMT2AGPR119MAPTMCHR1HDAC8 | |
| Bromide SCHEMBL7885616 | 0.90 | LIPE (0.41) | KMT2AGPR119MAPTMCHR1HDAC8 | |
| Bromide SCHEMBL8565830 | 0.85 | MCHR1 (0.37) | MCHR1ROCK2LIPE | |
| Bromide SCHEMBL8899830 | 0.85 | MCHR1 (0.37) | MCHR1ROCK2LIPE | |
| Bromide SCHEMBL8900489 | 0.85 | F10 (0.34) | MCHR1 | |
| Bromide SCHEMBL8565371 | 0.85 | F10 (0.34) | MCHR1 | |
| Bromide SCHEMBL8560227 | 0.83 | APP (0.38) | KMT2AMMP1MMP2MMP9ADAM17 | |
| Bromide SCHEMBL8900274 | 0.83 | APP (0.38) | KMT2AMMP1MMP2MMP9ADAM17 | |
| Bromide SCHEMBL8899176 | 0.82 | KMT2A (0.35) | KMT2AGPR119MAPTALDH1A1 |
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 |