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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9851591 | 0.98 | TSHR (0.36) | TSHR | |
| Bromide SCHEMBL9851723 | 0.86 | — | — | |
| SCHEMBL9851593 | 0.84 | S1PR4 (0.30) | — | |
| Bromide SCHEMBL9851612 | 0.81 | CYP2D6 (0.35) | TSHR | |
| SCHEMBL9851573 | 0.79 | KDM4E (0.37) | TSHR | |
| SCHEMBL19122827 | 0.68 | TSHR (0.39) | TSHR | |
| SCHEMBL21451668 | 0.68 | OPRM1 (0.30) | — | |
| SCHEMBL16330601 | 0.66 | KDM4E (0.33) | TSHR | |
| SCHEMBL23509325 | 0.66 | KDM4E (0.32) | — | |
| SCHEMBL9851577 | 0.66 | KDM4E (0.40) | — |
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-0417631-A2 | Condensed diazepinones, process for their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1991-03-20 | — | — | EP | disclosed |