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 | 2/20 | 0.35 |
| ▸ | ADRA1A known ✓ | P35348 | 2/20 | 0.35 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.35 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.35 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D known ✓ | P25100 | 1/20 | 0.35 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.35 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.35 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.35 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28539633 | 0.79 | ALDH1A1 (0.41) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| SCHEMBL29441552 | 0.78 | RORC (0.57) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| SCHEMBL4213149 | 0.78 | RORC (0.57) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| SCHEMBL4229462 | 0.76 | TSHR (0.48) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| SCHEMBL5324416 | 0.71 | ALDH1A1 (0.41) | HSD17B10TSHRALDH1A1ALOX15TP53 | |
| SCHEMBL5324420 | 0.71 | ALDH1A1 (0.41) | HSD17B10TSHRALDH1A1ALOX15TP53 | |
| SCHEMBL11991459 | 0.71 | CA12 (0.53) | HSD17B10ALDH1A1HCAR3LMNAGAA | |
| SCHEMBL3720674 | 0.71 | ALOX15 (0.78) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| Bromide SCHEMBL11513468 | 0.70 | IDO1 (0.43) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 | |
| SCHEMBL8085472 | 0.69 | ALDH1A1 (0.55) | CYP3A4HSD17B10TSHRHIF1AALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0474402-B1 | Chromophore-containing compounds for opto-electronic applications | ICI PLC (GB) | 1995-05-24 | — | — | EP | disclosed |
| US-5290630-A | Chromophore-containing compounds for opto-electronic applications | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-03-01 | — | — | US | disclosed |
| EP-0474402-A2 | Chromophore-containing compounds for opto-electronic applications | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-03-11 | — | — | EP | disclosed |