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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 4/20 | 0.66 |
| ▸ | DRD2 | P14416 | 4/20 | 0.66 |
| ▸ | DRD1 | P21728 | 1/20 | 0.58 |
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 SCHEMBL239517 | 1.00 | HTR1A (0.66) | HTR1ADRD2DRD1 | |
| Bromide SCHEMBL241053 | 1.00 | HTR1A (0.66) | HTR1ADRD2DRD1 | |
| Bromide SCHEMBL238486 | 1.00 | HTR1A (0.66) | HTR1ADRD2DRD1 | |
| Bromide SCHEMBL253566 | 1.00 | HTR1A (0.66) | HTR1ADRD2DRD1 | |
| SCHEMBL7883665 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 | |
| SCHEMBL239251 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 | |
| SCHEMBL7879901 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 | |
| SCHEMBL7879742 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 | |
| SCHEMBL7877455 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 | |
| SCHEMBL7875641 | 0.99 | HTR1A (0.67) | HTR1ADRD2DRD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401255-A1 | CATECHOLAMINE DERIVATIVES AND PRODRUGS THEREOF | H. Lundbeck A/S (DK) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097087-A1 | CATECHOLAMINE DERIVATIVES AND PRODRUGS THEREOF | H. LUNDBECK A/S (DK) | 2010-09-02 | — | — | WO | disclosed |