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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | LIPA | P38571 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
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 SCHEMBL11028367 | 1.00 | TSHR (0.36) | TSHRNPSR1EPHX1LIPAGLA | |
| SCHEMBL6130349 | 0.97 | TSHR (0.37) | TSHRNPSR1EPHX1LIPAGLA | |
| SCHEMBL61662 | 0.97 | TSHR (0.37) | TSHRNPSR1EPHX1LIPAGLA | |
| SCHEMBL6130372 | 0.97 | TSHR (0.37) | TSHRNPSR1EPHX1LIPAGLA | |
| Bromide SCHEMBL28440282 | 0.87 | — | — | |
| SCHEMBL2452572 | 0.84 | LIPA (0.33) | TSHRNPSR1EPHX1LIPA | |
| SCHEMBL5615220 | 0.83 | EPHX1 (0.42) | EPHX1LIPAGLAEPHX2HSD11B1 | |
| SCHEMBL5270433 | 0.83 | — | — | |
| SCHEMBL22797 | 0.83 | — | — | |
| SCHEMBL999461 | 0.82 | EPHX1 (0.42) | TSHRNPSR1EPHX1GLAEPHX2 |
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-0077550-A2 | 1.4-Naphthoquinones, methods for their preparation and veterinary formulations thereof | THE WELLCOME FOUNDATION LIMITED (GB) | 1983-04-27 | — | — | EP | disclosed |