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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 3/20 | 0.36 |
| ▸ | CHRM4 known ✓ | P08173 | 3/20 | 0.36 |
| ▸ | CHRM5 known ✓ | P08912 | 3/20 | 0.36 |
| ▸ | CHRM3 known ✓ | P20309 | 3/20 | 0.36 |
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
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 SCHEMBL28584063 | 0.82 | HIF1A (0.44) | ALDH1A1LMNAHIF1ACHRM2CHRM4 | |
| Iodide SCHEMBL11784544 | 0.81 | HIF1A (0.42) | ALDH1A1KDM4ENPC1RAB9ALMNA | |
| Bromide SCHEMBL10826278 | 0.79 | ALDH1A1 (0.40) | ALDH1A1KDM4ENPC1RAB9ALMNA | |
| Iodide SCHEMBL11784562 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KDM4ENPC1RAB9ALMNA | |
| Bromide SCHEMBL510812 | 0.77 | HIF1A (0.43) | ALDH1A1NPC1RAB9AHIF1ATDP1 | |
| Iodide SCHEMBL5158487 | 0.73 | HIF1A (0.43) | ALDH1A1NPC1RAB9AHIF1ATDP1 | |
| Iodide SCHEMBL11476441 | 0.72 | HIF1A (0.34) | ALDH1A1KDM4ENPC1RAB9ALMNA | |
| SCHEMBL8485 | 0.72 | SLC6A2 (0.42) | ALDH1A1KDM4ENPC1RAB9ALMNA | |
| Iodide SCHEMBL3513621 | 0.71 | HIF1A (0.38) | ALDH1A1HIF1ATSHR | |
| Ammonia Solution, Strong SCHEMBL27469603 | 0.70 | SLC6A2 (0.41) | ALDH1A1KDM4ENPC1RAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| JP-3236384-A | — | — | None | — | — | JP | disclosed |
| JP-H03236384-A | BENZOFURAN DERIVATIVE | SHIONOGI & CO LTD | 1991-10-22 | — | — | JP | disclosed |