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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.33 |
| ▸ | F2RL1 | P55085 | 10/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | ADK | P55263 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 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 | |
|---|---|---|---|---|
| SCHEMBL2458385 | 0.90 | F2RL1 (0.33) | F2RL1ALDH1A1SMN1; SMN2ADRA2AADRA2B | |
| SCHEMBL28096061 | 0.89 | FPR2 (0.34) | F2RL1CSNK1A1TYRO3DYRK1BFPR2 | |
| SCHEMBL7421789 | 0.84 | FPR2 (0.41) | F2RL1ALDH1A1SMN1; SMN2ADRA2AADRA2B | |
| SCHEMBL2929069 | 0.84 | FPR2 (0.41) | F2RL1ALDH1A1SMN1; SMN2ADRA2AADRA2B | |
| SCHEMBL4950871 | 0.80 | ADRA2A (0.37) | F2RL1ALDH1A1SMN1; SMN2ADRA2AADRA2B | |
| SCHEMBL7416391 | 0.79 | — | — | |
| SCHEMBL1306359 | 0.79 | — | — | |
| Bromide SCHEMBL31384906 | 0.78 | F2RL1 (0.31) | F2RL1 | |
| SCHEMBL8977559 | 0.78 | F2RL1 (0.31) | F2RL1ADRA2AADRA2BADRA2CCSNK1A1 | |
| SCHEMBL9315694 | 0.78 | TBXAS1 (0.44) | ALDH1A1ADRA2AADRA2BADRA2CCSNK1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105949129-B | A kind of imidazoles bromide ionic liquid and its preparation method and application with amino | 辽宁大学 | 2019-02-19 | — | — | CN | claimed |
| CN-105949129-B | A kind of imidazoles bromide ionic liquid and its preparation method and application with amino | 辽宁大学 | 2019-02-19 | — | — | CN | disclosed |
| CN-106045913-B | A kind of imidazoles perrhenate ions liquid and its preparation method and application with amino | 辽宁大学 | 2018-10-26 | — | — | CN | disclosed |
| CN-106045913-A | Imidazolium perrhenate ionic liquid with amino groups as well as preparation method and application of imidazolium perrhenate ionic liquid | 辽宁大学 | 2016-10-26 | — | — | CN | disclosed |
| CN-105949129-A | Imidazolium bromide ionic liquid containing amine groups and preparation method and application of ionic liquid | 辽宁大学 | 2016-09-21 | — | — | CN | disclosed |