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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA known ✓ | P35790 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL29201398 | 0.97 | SLC6A2 (0.40) | SLC6A2TAAR1LMNACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL29201384 | 0.97 | SLC6A2 (0.40) | SLC6A2TAAR1LMNACYP2D6CYP2C9 | |
| Bromide SCHEMBL3932385 | 0.83 | CYP1A2 (0.37) | SLC6A2TAAR1LMNACYP2D6CYP2C9 | |
| Bromide SCHEMBL17396287 | 0.80 | SLC6A2 (0.35) | SLC6A2TAAR1LMNACYP2D6CYP2C9 | |
| Bromide SCHEMBL29201434 | 0.74 | ALDH1A1 (0.35) | TAAR1ALDH1A1CYP3A4 | |
| Bromide SCHEMBL29201311 | 0.72 | FDPS (0.32) | FDPS | |
| Iodide SCHEMBL29201303 | 0.70 | ALDH1A1 (0.35) | TAAR1ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL29201338 | 0.70 | ALDH1A1 (0.35) | TAAR1ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL29201314 | 0.69 | FDPS (0.32) | FDPS | |
| SCHEMBL6835655 | 0.67 | SLC6A2 (0.58) | SLC6A2TAAR1LMNACYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117813334-A | Onium salt, blocking agent dissociation catalyst for blocking isocyanate, blocked isocyanate composition containing blocking agent dissociation catalyst, thermosetting resin composition, cured product, and method for producing same | 广荣化学株式会社 | 2024-04-02 | — | — | CN | disclosed |