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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 9/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 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 SCHEMBL11700718 | 0.76 | — | — | |
| Bromide SCHEMBL11347475 | 0.75 | ALDH1A1 (0.50) | ALDH1A1MAPTSMN1; SMN2RAB9AGFER | |
| SCHEMBL10293223 | 0.74 | — | — | |
| SCHEMBL4790582 | 0.74 | ALDH1A1 (0.53) | ALDH1A1MAPTSMN1; SMN2RAB9AGFER | |
| Bromide SCHEMBL11435403 | 0.73 | ALDH1A1 (0.49) | ALDH1A1MAPTSMN1; SMN2RAB9AGFER | |
| Iodide SCHEMBL7334458 | 0.72 | — | — | |
| SCHEMBL10726585 | 0.72 | ALDH1A1 (0.54) | ALDH1A1MAPTSMN1; SMN2RAB9AGFER | |
| SCHEMBL6773584 | 0.71 | — | — | |
| SCHEMBL11584636 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL10726402 | 0.70 | ALDH1A1 (0.53) | ALDH1A1MAPTSMN1; SMN2RAB9AGFER |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022023027-A1 | NOVEL CHROMIUM-BASED CATALYTIC COMPOSITION AND ASSOCIATED METHOD FOR THE TRIMERISATION OF ETHYLENE TO HEXENE-1 | IFP Energies Nouvelles (FR) | 2022-02-03 | — | — | WO | disclosed |