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 | |
|---|---|---|---|---|
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.69 |
| ▸ | DRD1 | P21728 | 17/20 | 0.71 |
| ▸ | DRD2 | P14416 | 11/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | HPGD | P15428 | 3/20 | 0.69 |
| ▸ | DRD5 | P21918 | 3/20 | 0.69 |
| ▸ | MAPT | P10636 | 3/20 | 0.69 |
| ▸ | ADCY5 | O95622 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.69 |
| ▸ | THPO | P40225 | 2/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.69 |
| ▸ | ADCY6 | O43306 | 1/20 | 0.69 |
| ▸ | ADCY3 | O60266 | 1/20 | 0.69 |
| ▸ | ADCY9 | O60503 | 1/20 | 0.69 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.69 |
| ▸ | ADCY7 | P51828 | 1/20 | 0.69 |
| ▸ | ADCY2 | Q08462 | 1/20 | 0.69 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL10749331 | 0.99 | DRD1 (0.70) | DRD1DRD2KDM4EHPGDDRD5 | |
| SCHEMBL10749365 | 0.84 | DRD1 (0.66) | DRD1DRD2KDM4EHPGDDRD5 | |
| Skf-38393 SCHEMBL1874365 | 0.84 | DRD1 (1.00) | DRD1DRD2KDM4EHPGDDRD5 | |
| SCHEMBL10745719 | 0.83 | DRD1 (0.65) | DRD1DRD2KDM4EHPGDDRD5 | |
| Skf-38393 SCHEMBL30287850 | 0.82 | DRD1 (0.97) | DRD1DRD2KDM4EHPGDDRD5 | |
| Skf-38393 SCHEMBL29389401 | 0.82 | DRD1 (1.00) | DRD1DRD2KDM4EHPGDDRD5 | |
| Skf-38393 SCHEMBL469578 | 0.82 | DRD1 (1.00) | DRD1DRD2KDM4EHPGDDRD5 | |
| (R)-Skf-38393 SCHEMBL7941051 | 0.82 | DRD1 (1.00) | DRD1DRD2KDM4EHPGDDRD5 | |
| Bromide SCHEMBL10746790 | 0.82 | DRD1 (0.80) | DRD1DRD2KDM4EHPGDDRD5 | |
| SCHEMBL11607029 | 0.81 | DRD1 (0.65) | DRD1DRD2KDM4EHPGDDRD5 |
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-0244088-A2 | 1-Phenyl-3-benzazepine compounds and medicaments containing these compounds for treating gastrointestinal motility disorders | SMITHKLINE BEECHAM CORPORATION (US) | 1987-11-04 | — | — | EP | disclosed |