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 | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 2/20 | 0.79 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.63 |
| ▸ | DRD1 | P21728 | 14/20 | 1.00 |
| ▸ | DRD2 | P14416 | 8/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.81 |
| ▸ | MAPT | P10636 | 5/20 | 0.81 |
| ▸ | PMP22 | Q01453 | 5/20 | 0.81 |
| ▸ | LMNA | P02545 | 3/20 | 0.81 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.81 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.79 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.79 |
| ▸ | THPO | P40225 | 4/20 | 0.79 |
| ▸ | TSHR | P16473 | 4/20 | 0.79 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.79 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.79 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.79 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.77 |
| ▸ | MTOR | P42345 | 2/20 | 0.77 |
| ▸ | MEN1 | O00255 | 2/20 | 0.77 |
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 SCHEMBL29634894 | 1.00 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL7323497 | 0.99 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 | |
| Bromide SCHEMBL11496865 | 0.90 | DRD1 (0.82) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL11099766 | 0.89 | DRD1 (0.82) | DRD1DRD2KDM4EMAPTPMP22 | |
| Bromide SCHEMBL29634914 | 0.89 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 | |
| Bromide SCHEMBL12610614 | 0.89 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL34464664 | 0.88 | DRD1 (0.80) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL14495015 | 0.87 | DRD1 (0.79) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL30231809 | 0.87 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 | |
| SCHEMBL2970804 | 0.87 | DRD1 (1.00) | DRD1DRD2KDM4EMAPTPMP22 |
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-4192872-A | ANTI -PARKINSONISM ACTIVITY | SMITHKLINE CORPORATION (US) | 1980-03-11 | — | — | US | disclosed |
| US-4160765-A | Method for 6-bromination of 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds | SMITHKLINE CORPORATION (US) | 1979-07-10 | — | — | US | disclosed |