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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 16/20 | 0.52 |
| ▸ | SMO | Q99835 | 16/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
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 SCHEMBL2928115 | 0.85 | MAPK14 (0.53) | MAPK14SMO | |
| Bromide SCHEMBL243397 | 0.83 | MAPK14 (0.57) | MAPK14SMO | |
| SCHEMBL239706 | 0.82 | MAPK14 (0.58) | MAPK14SMO | |
| Bromide SCHEMBL2928108 | 0.80 | MAPK14 (0.51) | MAPK14SMO | |
| SCHEMBL2925962 | 0.74 | MAPK14 (0.46) | MAPK14SMO | |
| SCHEMBL3645908 | 0.74 | SMO (0.72) | MAPK14SMO | |
| SCHEMBL3649540 | 0.74 | SMO (0.77) | MAPK14SMO | |
| SCHEMBL243924 | 0.73 | MAPK14 (0.55) | MAPK14SMO | |
| SCHEMBL3688505 | 0.73 | SMO (0.80) | MAPK14SMO | |
| SCHEMBL242583 | 0.73 | MAPK14 (0.69) | MAPK14SMO |
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-1699766-B1 | AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS | ASTRAZENECA AB (SE) | 2010-08-11 | — | — | EP | disclosed |