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 | |
|---|---|---|---|---|
| ▸ | HTR1A known ✓ | P08908 | 2/20 | 0.37 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.37 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.37 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.37 |
| ▸ | SLC6A4 known ✓ | P31645 | 3/20 | 0.36 |
| ▸ | HTR1D known ✓ | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B known ✓ | P28222 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 10/20 | 0.65 |
| ▸ | DRD1 | P21728 | 3/20 | 0.65 |
| ▸ | DRD4 | P21917 | 3/20 | 0.65 |
| ▸ | DRD5 | P21918 | 3/20 | 0.65 |
| ▸ | DRD3 | P35462 | 3/20 | 0.65 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Skf-89124A SCHEMBL7382070 | 0.81 | DRD2 (0.97) | DRD2DRD1DRD4DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL11177329 | 0.80 | DRD2 (0.44) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL3604531 | 0.79 | DRD2 (0.97) | DRD2DRD1DRD4DRD5DRD3 | |
| Skf-89124A SCHEMBL2914813 | 0.79 | DRD2 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL10923362 | 0.77 | DRD2 (1.00) | DRD2DRD1DRD4DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL7374216 | 0.77 | DRD2 (0.88) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL11283750 | 0.76 | DRD2 (0.67) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL10919553 | 0.76 | DRD2 (0.68) | DRD2DRD1DRD4DRD5DRD3 | |
| Bromide SCHEMBL7384529 | 0.75 | DRD2 (0.64) | DRD2DRD1DRD4DRD5DRD3 | |
| SCHEMBL10920726 | 0.74 | DRD2 (0.70) | DRD2DRD1DRD4DRD5DRD3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0113964-B1 | 4-AMINOALKYL-2(3H)-INDOLONES | SMITHKLINE BECKMAN CORPORATION (US) | 1986-10-22 | — | — | EP | disclosed |
| US-4588740-A | Pharmaceutical methods using 4-aminoalkyl-2(3H)-indolones | SMITHKLINE BECKMAN CORPORATION (US) | 1986-05-13 | — | — | US | disclosed |
| EP-0113964-A1 | 4-Aminoalkyl-2(3H)-indolones | SMITHKLINE BECKMAN CORPORATION (US) | 1984-07-25 | — | — | EP | disclosed |
| US-4452808-A | HYPOTENSIVE AGENTS | SMITHKLINE BECKMAN CORPORATION (US) | 1984-06-05 | — | — | US | disclosed |
| EP-0046666-A1 | 2(3H)-indolones, process for their preparation and compositions containing them | SMITHKLINE BECKMAN CORPORATION (US) | 1982-03-03 | — | — | EP | disclosed |