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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7775357 | 0.99 | CSNK1D (0.37) | CSNK1DHCRTR1HCRTR2HTR2AHTR2C | |
| Bromide SCHEMBL7775344 | 0.91 | CSNK1D (0.46) | CSNK1D | |
| SCHEMBL7773430 | 0.90 | CSNK1D (0.46) | CSNK1D | |
| Bromide SCHEMBL7775341 | 0.87 | ADRA1A (0.44) | — | |
| SCHEMBL7775362 | 0.86 | ADRA1A (0.44) | — | |
| Bromide SCHEMBL7857246 | 0.83 | HTR2A (0.38) | CSNK1DHCRTR1HCRTR2HTR2AHTR2C | |
| SCHEMBL7775363 | 0.82 | HTR2A (0.38) | CSNK1DHCRTR1HCRTR2HTR2AHTR2C | |
| SCHEMBL7769219 | 0.81 | NPC1 (0.45) | — | |
| Bromide SCHEMBL7521158 | 0.79 | CSNK1D (0.44) | CSNK1DHCRTR1HCRTR2 | |
| SCHEMBL27565702 | 0.79 | DRD2 (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000018767-A9 | 2-PIPERAZINO ALKYLAMINO BENZOAZOLE DERIVATIVES: DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS | NEUROGEN CORP (US) | 2001-04-19 | — | — | WO | claimed |