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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9290888 | 0.98 | KDM4E (0.48) | KDM4ELMNAKEAP1SMN1; SMN2GAA | |
| SCHEMBL9861592 | 0.97 | KDM4E (0.49) | KDM4ELMNAKEAP1SMN1; SMN2GAA | |
| Bromide SCHEMBL9290820 | 0.89 | KDM4E (0.43) | KDM4ELMNAKEAP1SMN1; SMN2GAA | |
| SCHEMBL6445297 | 0.87 | KDM4E (0.44) | KDM4ELMNAKEAP1SMN1; SMN2GAA | |
| Bromide SCHEMBL10340648 | 0.87 | SIGMAR1 (0.43) | KDM4ELMNASIGMAR1HRH3 | |
| SCHEMBL10594659 | 0.85 | SIGMAR1 (0.43) | KDM4ELMNASIGMAR1HRH3 | |
| SCHEMBL2905469 | 0.82 | SIGMAR1 (0.51) | LMNASIGMAR1HRH3MAPT | |
| Bromide SCHEMBL9291053 | 0.81 | SIGMAR1 (0.39) | LMNASIGMAR1HRH3PAOX | |
| Iodide SCHEMBL4008478 | 0.80 | SIGMAR1 (0.50) | LMNASIGMAR1HRH3MAPT | |
| SCHEMBL2905192 | 0.80 | LMNA (0.52) | LMNASIGMAR1HRH3ALDH1A1TSHR |
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-5140048-A | Inhibitors of nonenzymatic cross-linking | THE ROCKEFELLER UNIVERSITY (US) | 1992-08-18 | — | — | US | disclosed |