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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 2/20 | 0.62 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.62 |
| ▸ | SLC6A4 known ✓ | P31645 | 2/20 | 0.62 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.62 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.62 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.62 |
| ▸ | ADRB3 known ✓ | P13945 | 6/20 | 0.61 |
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | GALR3 | O60755 | 1/20 | 0.62 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.62 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.61 |
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 SCHEMBL7110283 | 1.00 | ADRB2 (0.62) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL8080865 | 0.85 | ADRB3 (0.74) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL8080860 | 0.85 | ADRB3 (0.74) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL7145404 | 0.84 | ADRB3 (0.61) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL7145409 | 0.84 | ADRB3 (0.61) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL8082444 | 0.84 | ADRB3 (0.72) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL8082439 | 0.84 | ADRB3 (0.72) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL7103158 | 0.83 | ADRB3 (0.61) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL8082555 | 0.83 | ADRB3 (0.61) | ADRB2LMNAHIF1ASLC6A2SLC6A4 | |
| SCHEMBL7104478 | 0.83 | ADRB3 (0.58) | ADRB2LMNAHIF1ASLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1043308-B1 | PHENYLAMINOALKYLCARBOXYLIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME | KISSEI PHARMACEUTICAL (JP) | 2003-09-24 | — | — | EP | disclosed |
| EP-1043308-A1 | PHENYLAMINOALKYLCARBOXYLIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME | Kissei Pharmaceutical Co., Ltd. (JP) | 2000-10-11 | — | — | EP | disclosed |