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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | DRD2 | P14416 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | BLM | P54132 | 3/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MTOR | P42345 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | GMNN | O75496 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 SCHEMBL11269824 | 0.82 | SLC6A2 (0.50) | DRD2PARP1 | |
| Bromide SCHEMBL11105104 | 0.78 | SLC6A2 (0.71) | LMNAPMP22PARP1CYP2D6MAPK1 | |
| Bromide SCHEMBL11274611 | 0.77 | SLC6A2 (0.69) | LMNAPMP22PARP1CYP2D6MAPK1 | |
| SCHEMBL11098069 | 0.76 | SLC6A2 (0.72) | LMNAPMP22PARP1CYP2D6MAPK1 | |
| Bromide SCHEMBL11094035 | 0.70 | DRD2 (0.78) | KDM4EDRD2LMNABLMPMP22 | |
| Bromide SCHEMBL11093003 | 0.70 | DRD2 (0.62) | KDM4EDRD2LMNABLMPMP22 | |
| Bromide SCHEMBL11089672 | 0.70 | DRD2 (0.78) | KDM4EDRD2LMNABLMPMP22 | |
| Bromide SCHEMBL8905267 | 0.70 | ESR1 (0.53) | KDM4EDRD2LMNABLMPMP22 | |
| SCHEMBL11088986 | 0.69 | DRD2 (0.80) | KDM4EDRD2LMNABLMPMP22 | |
| SCHEMBL11096642 | 0.69 | DRD2 (0.64) | KDM4EDRD2LMNABLMPMP22 |
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 |