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 | 1/20 | 0.42 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6650547 | 0.86 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL6711344 | 0.86 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| Bromide SCHEMBL8437423 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL7324468 | 0.81 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL8441267 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL10578902 | 0.76 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL10702738 | 0.76 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL12305760 | 0.76 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL4251876 | 0.76 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B | |
| SCHEMBL9568209 | 0.76 | ALDH1A1 (0.66) | ALDH1A1MAPK1L3MBTL1HCAR2CDC25B |
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-5879894-A | DETECTION AND/OR QUANTITATION OF AT LEAST TWO SUBSTANCES IN A TEST SAMPLE; APPLICATION IN CLINICAL DIAGNOSTICS | CHIRON DIAGNOSTICS CORPORATION (US) | 1999-03-09 | — | — | US | disclosed |