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 | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.59 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.48 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.48 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.48 |
| ▸ | ADRB2 known ✓ | P07550 | 2/20 | 0.44 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.44 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.44 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.44 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.59 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | F13A1 | P00488 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28158434 | 0.98 | TMEM97 (0.61) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| Bromide SCHEMBL27562319 | 0.79 | TMEM97 (0.61) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| SCHEMBL7381628 | 0.78 | TMEM97 (0.67) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| Bromide SCHEMBL31316307 | 0.78 | L3MBTL1 (0.60) | SIGMAR1KDM4ECA2SLC6A2ALDH1A1 | |
| Bromide SCHEMBL27615440 | 0.77 | TMEM97 (0.59) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| Bromide SCHEMBL6337077 | 0.77 | TMEM97 (0.95) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| SCHEMBL14421198 | 0.76 | TAAR1 (0.64) | KDM4EALDH1A1CYP2C19TAAR1L3MBTL1 | |
| SCHEMBL1091362 | 0.76 | TMEM97 (0.64) | TMEM97SIGMAR1ESR1ESR2KDM4E | |
| SCHEMBL18122725 | 0.76 | OPRK1 (0.64) | TMEM97SIGMAR1SLC6A2OPRK1ADRB2 | |
| SCHEMBL1231267 | 0.75 | L3MBTL1 (0.62) | SIGMAR1KDM4ECA2SLC6A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0325245-A1 | Phenoxyacetic acid derivatives, preparation thereof, pharmaceutical compositions comprising them and use | TANABE SEIYAKU CO., LTD. (JP) | 1989-07-26 | — | — | EP | disclosed |