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 | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | SNCA | P37840 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 6/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.41 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.41 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | PLAT | P00750 | 1/20 | 0.40 |
| ▸ | KLK1 | P06870 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6153295 | 0.82 | SNCA (0.55) | RELASNCACHRNA7PPARA | |
| Hydrochloric Acid SCHEMBL8985765 | 0.82 | SNCA (0.55) | RELASNCACHRNA7PPARA | |
| Bromide SCHEMBL1138243 | 0.82 | SNCA (0.53) | SNCAPPARA | |
| Hydrochloric Acid SCHEMBL1018122 | 0.79 | SNCA (0.50) | SNCA | |
| SCHEMBL5407848 | 0.76 | RELA (1.00) | RELAALDH1A1GLAMAPTSMN1; SMN2 | |
| SCHEMBL3984479 | 0.76 | RELA (1.00) | RELAALDH1A1GLAMAPTSMN1; SMN2 | |
| SCHEMBL5407847 | 0.76 | RELA (1.00) | RELAALDH1A1GLAMAPTSMN1; SMN2 | |
| SCHEMBL30507765 | 0.76 | RELA (1.00) | RELAALDH1A1GLAMAPTSMN1; SMN2 | |
| Bromide SCHEMBL39844 | 0.76 | SNCA (0.73) | SNCAALDH1A1 | |
| SCHEMBL5552162 | 0.74 | RELA (0.86) | RELAALDH1A1GLAMAPTSMN1; SMN2 |
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-111122529-B | Application of gold nanoclusters in detection of protein amyloid fibrosis in biological sample and screening of inhibitor | 陕西师范大学 | 2022-07-08 | — | — | CN | disclosed |