Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 3/20 | 0.50 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | CCR4 | P51679 | 1/20 | 0.38 |
| ▸ | SLC26A3 | P40879 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1848567 | 0.97 | ALOX5 (0.56) | ALOX5HTR2BGPR52MTNR1AMTNR1B | |
| SCHEMBL1852157 | 0.93 | ALOX5 (0.52) | ALOX5HTR2BGPR52MTNR1AMTNR1B | |
| SCHEMBL1849327 | 0.81 | MTNR1A (0.46) | ALOX5HTR2BGPR52MTNR1AMTNR1B | |
| SCHEMBL3198348 | 0.78 | MAOB (0.40) | ALOX5HTR2BGPR52MTNR1AMTNR1B | |
| SCHEMBL1848465 | 0.75 | MAOB (0.38) | ALOX5HTR2BGPR52MTNR1AMTNR1B | |
| SCHEMBL1852178 | 0.75 | GPR52 (0.56) | GPR52MTNR1AMTNR1B | |
| SCHEMBL1857128 | 0.71 | HTR2B (0.47) | HTR2BMAPTKMT2ATDP1ACP3 | |
| SCHEMBL9740770 | 0.70 | ALOX5 (1.00) | ALOX5HTR2BHTR2CMAPTNPC1 | |
| SCHEMBL1855422 | 0.69 | GPR52 (0.53) | HTR2BGPR52MTNR1AMTNR1BMAOB | |
| SCHEMBL10744144 | 0.69 | ALOX5 (0.57) | ALOX5HTR2BARHTR2CMAPT |
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-2323978-A1 | AMIDE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010018874-A1 | AMIDE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-02-18 | — | — | WO | disclosed |