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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28409379 | 0.99 | ALDH1A1 (0.35) | ALDH1A1MAPTHPGDMCL1TDP1 | |
| Bromide SCHEMBL28412751 | 0.85 | DRD2 (0.41) | ALDH1A1MAPTHPGDDRD2DRD4 | |
| SCHEMBL28891609 | 0.84 | MEN1 (0.42) | ALDH1A1MAPTDRD2DRD4KDM4E | |
| SCHEMBL30056333 | 0.84 | MEN1 (0.42) | ALDH1A1MAPTDRD2DRD4KDM4E | |
| Bromide SCHEMBL28415457 | 0.81 | MAPT (0.39) | ALDH1A1MAPTHPGDMCL1TDP1 | |
| Bromide SCHEMBL30053886 | 0.81 | MAPT (0.39) | ALDH1A1MAPTHPGDMCL1TDP1 | |
| SCHEMBL28412475 | 0.79 | MAPT (0.40) | ALDH1A1MAPTHPGDMCL1TDP1 | |
| SCHEMBL30053872 | 0.78 | SLC6A2 (0.43) | ALDH1A1SMN1; SMN2HIF1ADRD2DRD4 | |
| SCHEMBL28409909 | 0.78 | SLC6A2 (0.43) | ALDH1A1SMN1; SMN2HIF1ADRD2DRD4 | |
| SCHEMBL30052960 | 0.77 | MAPT (0.41) | ALDH1A1MAPTHPGDMCL1TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111315829-B | Small molecule organic dye | 巴塞尔大学 | 2022-11-04 | — | — | CN | disclosed |
| CN-111315829-A | Small molecule organic dye | 巴塞尔大学 | 2020-06-19 | — | — | CN | disclosed |