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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27510812 | 0.97 | HPGD (0.50) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| Bromide SCHEMBL28377860 | 0.84 | TP53 (0.48) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| SCHEMBL28113090 | 0.80 | TP53 (0.50) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| SCHEMBL27595863 | 0.80 | TP53 (0.50) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| Hydrochloric Acid SCHEMBL28379786 | 0.78 | TP53 (0.48) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| SCHEMBL27763778 | 0.76 | TP53 (0.46) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| Bromide SCHEMBL27613682 | 0.75 | HPGD (0.43) | HPGDCALM1LOXL2EPHX2TSHR | |
| SCHEMBL1486343 | 0.73 | EPHX2 (0.48) | HPGDCALM1LOXL2CYP2A6HTR2A | |
| SCHEMBL388208 | 0.73 | HPGD (0.73) | HPGDCALM1EPHX2TSHRALDH1A1 | |
| SCHEMBL27569486 | 0.73 | TP53 (0.48) | HPGDCALM1LOXL2EPHX2TSHR |
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-118307592-A | Quaternary phosphate compound and preparation method thereof | 北京大学 | 2024-07-09 | — | — | CN | disclosed |