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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.54 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 11/20 | 0.61 |
| ▸ | DRD3 | P35462 | 11/20 | 0.61 |
| ▸ | FYN | P06241 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | DRD4 | P21917 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
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 SCHEMBL7360028 | 1.00 | DRD2 (0.61) | DRD2DRD3FYNLMNAMEN1 | |
| Bromide SCHEMBL8383412 | 0.92 | DRD2 (0.62) | DRD2DRD3FYNLMNAMEN1 | |
| Bromide SCHEMBL8383414 | 0.92 | DRD2 (0.62) | DRD2DRD3FYNLMNAMEN1 | |
| Hydrochloric Acid SCHEMBL7353323 | 0.90 | FYN (0.60) | DRD2DRD3FYNLMNADRD4 | |
| Hydrochloric Acid SCHEMBL7353318 | 0.90 | FYN (0.60) | DRD2DRD3FYNLMNADRD4 | |
| Hydrochloric Acid SCHEMBL7359091 | 0.89 | DRD2 (0.61) | DRD2DRD3FYNDRD4 | |
| Hydrochloric Acid SCHEMBL8380639 | 0.89 | DRD2 (0.61) | DRD2DRD3FYNDRD4 | |
| SCHEMBL7364690 | 0.88 | DRD3 (0.63) | DRD2DRD3FYN | |
| SCHEMBL7364686 | 0.88 | DRD3 (0.63) | DRD2DRD3FYN | |
| Bromide SCHEMBL8384061 | 0.86 | DRD2 (0.71) | DRD2DRD3DRD4HTR1AADRB2 |
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-0781268-B1 | DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM | ZAMBON SPA (IT) | 1999-04-07 | — | — | EP | disclosed |
| WO-1996008463-A1 | DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM | ZAMBON GROUP S.P.A. (IT) | 1996-03-21 | — | — | WO | disclosed |