Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
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 | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | STAT6 | P42226 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| SCHEMBL1954703 | 0.98 | FFAR3 (0.59) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| SCHEMBL20818890 | 0.98 | FFAR3 (0.59) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| SCHEMBL9044165 | 0.98 | FFAR3 (0.59) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| Hydrochloric Acid SCHEMBL20818937 | 0.95 | FFAR3 (0.56) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| Hydrochloric Acid SCHEMBL8949215 | 0.95 | FFAR3 (0.56) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| SCHEMBL1965493 | 0.84 | FFAR3 (0.48) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| SCHEMBL3545761 | 0.84 | FFAR3 (0.48) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| SCHEMBL27893190 | 0.84 | FFAR3 (0.48) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| Hydrochloric Acid SCHEMBL1177624 | 0.83 | FFAR3 (0.46) | FFAR3MAPK1CYP2C19LMNAMTOR | |
| Hydrochloric Acid SCHEMBL1178166 | 0.83 | FFAR3 (0.46) | FFAR3MAPK1CYP2C19LMNAMTOR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0044541-A1 | Aminocarboxylic acids, amino alcohols, or the derivatives thereof, processes for production thereof, and pharmaceutical composition, containing at least one of these compounds | TEIJIN LIMITED (JP) | 1982-01-27 | — | — | EP | disclosed |