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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 4/20 | 0.45 |
| ▸ | NOS3 | P29474 | 4/20 | 0.45 |
| ▸ | NOS2 | P35228 | 4/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20524263 | 0.79 | NOS1 (0.43) | PPARDNOS1NOS3NOS2HRH4 | |
| SCHEMBL4367124 | 0.72 | NOS1 (0.42) | NOS1NOS3NOS2HRH4TDP1 | |
| Diethyl Hydrogen Phosphate SCHEMBL2788463 | 0.70 | NOS3 (0.58) | PPARDNOS1NOS3NOS2HRH4 | |
| SCHEMBL3313657 | 0.68 | PPARD (0.70) | PPARDTDP1TSHRCYP2C19 | |
| SCHEMBL13529823 | 0.68 | PPARD (0.47) | PPARDTDP1TSHRCYP2C19 | |
| SCHEMBL5839773 | 0.67 | PPARD (0.56) | PPARDTDP1CYP1A2MAPTCYP3A4 | |
| Bromide SCHEMBL28063297 | 0.67 | — | — | |
| Bromide SCHEMBL31317494 | 0.67 | — | — | |
| SCHEMBL13707148 | 0.67 | CYP1A2 (0.44) | NOS1NOS3NOS2HRH4TDP1 | |
| Diethyl Hydrogen Phosphate SCHEMBL28772823 | 0.67 | NOS3 (0.52) | PPARDNOS1NOS3NOS2HRH4 |
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-4656660-A1 | ALFA-, BETA-, AND GAMMA- CYCLODEXTRIN DERIVATIVES DECORATED WITH (2-MERCAPTOETHYL)PHOSPHONIC ACID BRANCHES, SYNTHESIS AND APPLICATIONS | Universidad de Almeria (ES) | 2025-12-03 | — | — | EP | disclosed |