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 | 0.40 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL28891609 | 0.98 | MEN1 (0.42) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL30056333 | 0.98 | MEN1 (0.42) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL28409909 | 0.91 | SLC6A2 (0.43) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL30053872 | 0.91 | SLC6A2 (0.43) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL18052558 | 0.90 | MGLL (0.41) | MEN1KMT2AATMMGLLALDH1A1 | |
| Bromide SCHEMBL28415457 | 0.86 | MAPT (0.39) | DRD2DRD4MEN1KMT2AATM | |
| Bromide SCHEMBL30053886 | 0.86 | MAPT (0.39) | DRD2DRD4MEN1KMT2AATM | |
| Bromide SCHEMBL28414889 | 0.86 | SLC6A2 (0.44) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL28412475 | 0.85 | MAPT (0.40) | DRD2DRD4MEN1KMT2AATM | |
| SCHEMBL30056324 | 0.84 | SLC6A2 (0.46) | DRD2DRD4MEN1KMT2AATM |
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 |