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 | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | SNCA | P37840 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | C1R | P00736 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | TACR1 | P25103 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11062554 | 0.96 | HIF1A (0.44) | HIF1ASNCATAAR1IDO1CYP1A2 | |
| Bromide SCHEMBL2446627 | 0.84 | HIF1A (0.55) | HIF1ASNCATAAR1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL9292231 | 0.80 | HIF1A (0.55) | HIF1ASNCATAAR1CYP1A2CYP2D6 | |
| Bromide SCHEMBL8464686 | 0.78 | HIF1A (0.48) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL2552144 | 0.78 | BACE1 (0.39) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL2557877 | 0.78 | SNCA (0.37) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL4287071 | 0.77 | HIF1A (0.46) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL1465677 | 0.75 | HIF1A (0.44) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL4175689 | 0.75 | HIF1A (0.44) | HIF1ASNCACYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL2451357 | 0.75 | HIF1A (0.44) | HIF1ASNCATAAR1TSHRALDH1A1 |
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-4446123-A | QUATERNARY AMMONIUM, PHOSPHONIUM, OR ARSONIUM HALIDE | HAHNEMANN UNIVERSITY (US) | 1984-05-01 | — | — | US | claimed |
| US-4446123-A | QUATERNARY AMMONIUM, PHOSPHONIUM, OR ARSONIUM HALIDE | HAHNEMANN UNIVERSITY (US) | 1984-05-01 | — | — | US | disclosed |