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 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 3/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28270201 | 0.98 | CYP17A1 (0.39) | CYP17A1CYP19A1 | |
| Water SCHEMBL28525525 | 0.97 | CYP17A1 (0.38) | CYP17A1CYP19A1 | |
| SCHEMBL28095052 | 0.92 | CYP17A1 (0.38) | CYP17A1CYP19A1 | |
| Bromide SCHEMBL28122988 | 0.83 | CYP17A1 (0.42) | CYP17A1CYP19A1 | |
| SCHEMBL28111930 | 0.81 | CYP17A1 (0.39) | CYP17A1CYP19A1 | |
| SCHEMBL27727132 | 0.81 | CYP17A1 (0.43) | CYP17A1CYP19A1 | |
| Bromide SCHEMBL27657528 | 0.80 | CYP17A1 (0.45) | CYP17A1CYP19A1 | |
| SCHEMBL27657529 | 0.79 | CYP17A1 (0.38) | CYP17A1CYP19A1 | |
| Water SCHEMBL28070577 | 0.79 | CYP17A1 (0.42) | CYP17A1CYP19A1 | |
| Bromide SCHEMBL28038388 | 0.79 | CYP17A1 (0.40) | CYP17A1CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109092265-B | Cellulose-based adsorbent modified by polyimidazole ionic liquid and preparation method and application thereof | 陕西科技大学 | 2021-02-19 | — | — | CN | claimed |
| CN-112142872-B | Alkaline ionic liquid grafted chitin, and preparation method and application thereof | 常州大学 | 2022-05-31 | — | — | CN | disclosed |
| CN-109092265-B | Cellulose-based adsorbent modified by polyimidazole ionic liquid and preparation method and application thereof | 陕西科技大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-112142872-A | Alkaline ionic liquid grafted chitin, and preparation method and application thereof | 常州大学 | 2020-12-29 | — | — | CN | disclosed |