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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 5/20 | 0.39 |
| ▸ | PDE1A | P54750 | 4/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 4/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PKLR | P30613 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 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 | |
|---|---|---|---|---|
| SCHEMBL10668309 | 0.87 | CYP3A4 (0.42) | CYP3A4ROCK2NPBWR1PDE1APDE1B | |
| Bromide SCHEMBL10582081 | 0.85 | CNR2 (0.39) | CNR2BCHEACHEROCK2NPBWR1 | |
| Bromide SCHEMBL10582074 | 0.85 | CNR2 (0.39) | CNR2BCHEACHEROCK2NPBWR1 | |
| SCHEMBL10664066 | 0.83 | CYP3A4 (0.41) | CYP3A4ROCK2NPBWR1PDE1APDE1B | |
| Bromide SCHEMBL10582253 | 0.73 | KAT2B (0.41) | ROCK2NPBWR1PDGFRBPDGFRA | |
| Bromide SCHEMBL10582244 | 0.73 | KAT2B (0.41) | ROCK2NPBWR1PDGFRBPDGFRA | |
| SCHEMBL10581087 | 0.72 | KAT2B (0.42) | ROCK2NPBWR1PDGFRBPDGFRA | |
| SCHEMBL10581084 | 0.72 | KAT2B (0.42) | ROCK2NPBWR1PDGFRBPDGFRA | |
| SCHEMBL25179348 | 0.71 | RET (0.46) | CYP3A4ROCK2NPBWR1MEN1KMT2A | |
| SCHEMBL31051557 | 0.71 | RET (0.46) | CYP3A4ROCK2NPBWR1MEN1KMT2A |
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-4769369-A | Anti-allergy 1(2H)-phthalazinones | PENNWALT CORPORATION (US) | 1988-09-06 | — | — | US | disclosed |