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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.56 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 3/20 | 0.96 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | DRD3 | P35462 | 5/20 | 0.59 |
| ▸ | DRD2 | P14416 | 4/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | DRD4 | P21917 | 2/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8443814 | 0.98 | FYN (1.00) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 | |
| Bromide SCHEMBL7198686 | 0.89 | FYN (0.97) | FYNCYP2D6ALDH1A1DRD3DRD2 | |
| SCHEMBL29177063 | 0.88 | FYN (0.81) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 | |
| SCHEMBL22417780 | 0.87 | FYN (0.80) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 | |
| SCHEMBL10606282 | 0.86 | FYN (1.00) | FYNCYP2D6DRD3DRD2LMNA | |
| Bromide SCHEMBL8688813 | 0.83 | DRD3 (0.78) | FYNCYP2D6ALDH1A1CYP2C9DRD3 | |
| SCHEMBL7090402 | 0.81 | FYN (0.69) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 | |
| SCHEMBL8693035 | 0.81 | FYN (0.70) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 | |
| SCHEMBL7449385 | 0.81 | DRD3 (0.78) | FYNCYP2D6ALDH1A1CYP2C9DRD3 | |
| SCHEMBL27483394 | 0.80 | FYN (0.68) | FYNCYP2D6ALDH1A1CYP2C9ALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5708018-A | 2-aminoindans as selective dopamine D3 ligands | PHARMACIA & UPJOHN COMPANY (US) | 1998-01-13 | — | — | US | disclosed |
| EP-0712387-A1 | 2-AMINOINDANS AS SELECTIVE DOPAMINE D3 LIGANDS | PHARMACIA & UPJOHN COMPANY (US) | 1996-05-22 | — | — | EP | disclosed |
| WO-1995004713-A1 | 2-AMINOINDANS AS SELECTIVE DOPAMINE D3 LIGANDS | THE UPJOHN COMPANY (US) | 1995-02-16 | — | — | WO | disclosed |