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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 5/20 | 0.57 |
| ▸ | DRD3 | P35462 | 5/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL29016368 | 1.00 | DRD2 (0.57) | DRD2DRD3MAPTKDM4ENFKB1 | |
| Bromide SCHEMBL29016370 | 1.00 | DRD2 (0.57) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL30057164 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL3316692 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL754233 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL6958473 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL30058138 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| SCHEMBL30059639 | 0.98 | DRD2 (0.59) | DRD2DRD3MAPTKDM4ENFKB1 | |
| Hydrochloric Acid SCHEMBL754377 | 0.96 | DRD2 (0.57) | DRD2DRD3MAPTKDM4ENFKB1 | |
| Hydrochloric Acid SCHEMBL754376 | 0.96 | DRD2 (0.57) | DRD2DRD3MAPTKDM4ENFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116063186-A | Process and intermediates for the preparation of (S) -2-amino-5, 7-difluoro-1, 2,3, 4-tetrahydronaphthalene hydrogen halides | 江苏亚虹医药科技股份有限公司 | 2023-05-05 | — | — | CN | disclosed |