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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 8/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9545818 | 0.90 | MAOB (0.44) | MAOBNR1H4SIRT1OPRM1OPRD1 | |
| Bromide SCHEMBL8633989 | 0.80 | MMP2 (0.39) | SIRT1MMP2MMP13MAPT | |
| SCHEMBL8637040 | 0.79 | MMP2 (0.40) | SIRT1MMP2MMP13MAPT | |
| SCHEMBL8893376 | 0.75 | SIRT1 (0.41) | MAOBSIRT1MMP2MMP13MAPT | |
| SCHEMBL9545815 | 0.73 | MAOB (0.42) | MAOBSIRT1OPRM1OPRD1ACHE | |
| SCHEMBL9231335 | 0.73 | NR1H4 (0.41) | MAOBNR1H4SIRT1OPRM1OPRD1 | |
| SCHEMBL9207805 | 0.73 | RAB9A (0.40) | MAOBSIRT1ACHEFFAR1MAOA | |
| SCHEMBL8892271 | 0.71 | LMNA (0.52) | MAPT | |
| SCHEMBL8902452 | 0.70 | SIRT1 (0.39) | SIRT1MMP2MMP13MAPT | |
| SCHEMBL9202236 | 0.69 | SIRT1 (0.37) | SIRT1MMP2MMP13 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993022299-A1 | FUNGICIDAL OXAZOLIDINONES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-11-11 | — | — | WO | disclosed |