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 | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.68 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.67 |
| ▸ | DRD1 | P21728 | 13/20 | 0.72 |
| ▸ | DRD5 | P21918 | 5/20 | 0.68 |
| ▸ | DRD2 | P14416 | 4/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.68 |
| ▸ | THPO | P40225 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.68 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | GPR183 | P32249 | 1/20 | 0.67 |
| ▸ | APLNR | P35414 | 1/20 | 0.67 |
| ▸ | GLP1R | P43220 | 1/20 | 0.67 |
| ▸ | CX3CR1 | P49238 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690780 | 0.99 | DRD1 (0.73) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL14502337 | 0.84 | DRD1 (1.00) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL7919616 | 0.83 | DRD1 (0.77) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL13900337 | 0.83 | DRD1 (0.82) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL10687601 | 0.83 | DRD1 (0.60) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| Bromide SCHEMBL10692385 | 0.82 | DRD1 (0.75) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL10687419 | 0.82 | DRD1 (0.66) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL5138043 | 0.82 | DRD1 (1.00) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL29602922 | 0.82 | DRD1 (1.00) | DRD1DRD5DRD2CYP1A2CYP2D6 | |
| SCHEMBL29507713 | 0.82 | DRD1 (1.00) | DRD1DRD5DRD2CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4751222-A | 2,3,4,5-tetrahydro-1H-3-benzazepines and CNS affecting use thereof | NOVO INDUSTRI A/S (DK) | 1988-06-14 | — | — | US | disclosed |
| EP-0200455-A2 | 2,3,4,5-tetrahydro-1H-3-benzazepines substituted in position 5 | NOVO NORDISK A/S (DK) | 1986-11-05 | — | — | EP | disclosed |