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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 SCHEMBL8899418 | 1.00 | TSHR (0.39) | TSHRALDH1A1CYP2C19SMN1; SMN2 | |
| Bromide SCHEMBL8561370 | 1.00 | TSHR (0.39) | TSHRALDH1A1CYP2C19SMN1; SMN2 | |
| Bromide SCHEMBL5198501 | 0.79 | HSD11B1 (0.42) | ALDH1A1 | |
| Bromide SCHEMBL5198499 | 0.79 | HSD11B1 (0.42) | ALDH1A1 | |
| Bromide SCHEMBL9766123 | 0.77 | TSHR (0.36) | TSHRALDH1A1CYP2C19 | |
| Bromide SCHEMBL7612999 | 0.72 | KDM4E (0.35) | — | |
| Bromide SCHEMBL7612993 | 0.72 | KDM4E (0.35) | — | |
| Bromide SCHEMBL8310683 | 0.71 | SRD5A1 (0.35) | TSHRALDH1A1CYP2C19SMN1; SMN2 | |
| Bromide SCHEMBL9079449 | 0.71 | HSD11B1 (0.40) | ALDH1A1 | |
| Bromide SCHEMBL9079445 | 0.71 | HSD11B1 (0.40) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0761673-A1 | Cephalosporin derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1997-03-12 | — | — | EP | disclosed |