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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.50 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.50 |
| ▸ | HTR1A known ✓ | P08908 | 3/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
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 SCHEMBL11105104 | 0.84 | SLC6A2 (0.71) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| Bromide SCHEMBL11274611 | 0.83 | SLC6A2 (0.69) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| Bromide SCHEMBL11269333 | 0.82 | KDM4E (0.49) | PARP1DRD2 | |
| SCHEMBL11098069 | 0.82 | SLC6A2 (0.72) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| Bromide SCHEMBL11126431 | 0.73 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3NPC1RAB9A | |
| Bromide SCHEMBL11258851 | 0.73 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| Bromide SCHEMBL11107064 | 0.72 | NPC1 (0.55) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| SCHEMBL4035350 | 0.72 | SLC6A2 (0.70) | SLC6A2SLC6A4SLC6A3PARP1NPC1 | |
| SCHEMBL11101484 | 0.72 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3NPC1RAB9A | |
| SCHEMBL11100674 | 0.72 | NPC1 (0.57) | SLC6A2SLC6A4SLC6A3PARP1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4340600-A | Renal dilating methods and compositions using 4-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydroisoquinolines | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |