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 | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | SNCA | P37840 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | CTSG | P08311 | 1/20 | 0.37 |
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 SCHEMBL27508503 | 0.84 | SNCA (0.41) | ABCB1SNCANPC1RAB9AHTR1A | |
| Phosphine SCHEMBL28080395 | 0.83 | SNCA (0.40) | ABCB1SNCANPC1RAB9AHTR1A | |
| SCHEMBL27849168 | 0.81 | SNCA (0.38) | ABCB1SNCANPC1RAB9AHTR1A | |
| Bromide SCHEMBL1149819 | 0.77 | ABCB1 (0.48) | ABCB1ABCG2BCHENFE2L2SMN1; SMN2 | |
| Bromide SCHEMBL7872610 | 0.76 | SNCA (0.41) | SNCAHTR1AADRA1DADRA1AADRA1B | |
| Bromide SCHEMBL723263 | 0.75 | PTGS2 (0.47) | ABCB1SNCASMN1; SMN2KDM4EALDH1A1 | |
| Phosphine SCHEMBL28014269 | 0.74 | PTGS2 (0.46) | ABCB1SNCASMN1; SMN2KDM4EALDH1A1 | |
| Water SCHEMBL4390663 | 0.73 | HTR1A (0.40) | SNCAHTR1AADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL7874564 | 0.73 | HTR1A (0.40) | SNCAHTR1AADRA1DADRA1AADRA1B | |
| Bromide SCHEMBL4180528 | 0.73 | CA1 (0.43) | SNCACYP2D6CYP2C19SMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4428965-A | Tolerizing and desensitizing compounds, compositions and methods of treatment against dermatological conditions caused by allergens from plants and trees of the Anacardiaceae and Ginkgoaceae families | THE UNIVERSITY OF MISSISSIPPI (US) | 1984-01-31 | — | — | US | disclosed |