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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 5/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.38 |
| ▸ | MAOB | P27338 | 4/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3893100 | 0.98 | KDM4E (0.46) | KDM4EALDH1A1GAAMEN1LMNA | |
| SCHEMBL3896879 | 0.87 | KDM4E (0.35) | KDM4EALDH1A1GAAMEN1LMNA | |
| SCHEMBL9567328 | 0.86 | ALDH1A1 (0.41) | KDM4EALDH1A1GAAMEN1LMNA | |
| SCHEMBL3893630 | 0.85 | AR (0.40) | KDM4EALDH1A1GAAMEN1LMNA | |
| SCHEMBL27633703 | 0.84 | KDM4E (0.44) | KDM4EALDH1A1GAAKMT2AHTT | |
| SCHEMBL6561277 | 0.84 | KIF11 (0.49) | KDM4EALDH1A1ARTDP1 | |
| SCHEMBL3890191 | 0.83 | PTGES (0.38) | ARMAOAMAOBERBB2 | |
| SCHEMBL9390186 | 0.83 | AR (0.54) | AR | |
| SCHEMBL10590631 | 0.83 | AR (0.54) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL6561382 | 0.83 | MAOA (0.37) | KDM4EALDH1A1GAAMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112430205-B | Preparation method of arylpyrrole compound | 湖南海利常德农药化工有限公司 | 2022-06-21 | — | — | CN | disclosed |