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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRAP1 | Q12931 | 3/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 9/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5809886 | 0.88 | HIF1A (0.48) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL29124942 | 0.74 | PRSS1 (0.34) | HIF1AALDH1A1 | |
| Bromide SCHEMBL2450121 | 0.74 | HIF1A (0.70) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL7634128 | 0.74 | HIF1A (0.70) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL4184421 | 0.74 | HIF1A (0.70) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL52420 | 0.74 | HIF1A (0.70) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL3391859 | 0.74 | HIF1A (0.70) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL7471970 | 0.74 | HIF1A (0.46) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL8999525 | 0.72 | HIF1A (0.67) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 | |
| Bromide SCHEMBL2446042 | 0.72 | HIF1A (0.74) | TRAP1HIF1ACHRNA7ALDH1A1CYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5599837-A | 15-DEOXYPROSTAGLANDINS | SHIONOGI & CO., LTD. (JP) | 1997-02-04 | — | — | US | disclosed |
| EP-0471856-B1 | 15-DEOXYPROSTAGLANDIN DERIVATIVE | SHIONOGI & CO (JP) | 1995-03-22 | — | — | EP | disclosed |
| US-5292754-A | Using 15-deoxyprostaglandin derivative | SHIONOGI & CO., LTD. (JP) | 1994-03-08 | — | — | US | disclosed |
| EP-0471856-A1 | 15-DEOXYPROSTAGLANDIN DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1992-02-26 | — | — | EP | disclosed |