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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL27613682 | 0.84 | HPGD (0.43) | CYP2C19HPGDTSHRALOX12IDO1 | |
| SCHEMBL3188266 | 0.82 | HPGD (0.44) | CYP2C19HPGDTSHRALOX12IDO1 | |
| Hydrochloric Acid SCHEMBL25296192 | 0.80 | HPGD (0.43) | CYP2C19HPGDTSHRIDO1ALDH1A1 | |
| Iodide SCHEMBL27594781 | 0.80 | HPGD (0.43) | CYP2C19HPGDTSHRALOX12IDO1 | |
| Hydrochloric Acid SCHEMBL27990626 | 0.80 | HPGD (0.43) | CYP2C19HPGDTSHRIDO1ALDH1A1 | |
| Bromide SCHEMBL27276510 | 0.79 | PLA2G1B (0.39) | POLBIDO1TDP1NPC1RAB9A | |
| Bromide SCHEMBL29282635 | 0.79 | ALDH1A1 (0.40) | HTTCYP2C19HPGDTSHRIDO1 | |
| Bromide SCHEMBL28001886 | 0.79 | LTA4H (0.55) | HTTCYP2C19TSHRACHESMN1; SMN2 | |
| SCHEMBL20462898 | 0.78 | CYP3A4 (0.58) | HTTCYP2C19HPGDALOX12L3MBTL1 | |
| SCHEMBL28471292 | 0.77 | PLA2G1B (0.40) | POLBIDO1TDP1NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1016336-B | Olefines pesticide composition and preparation method thereof | ICI PLC (GB) | 1992-04-22 | — | — | CN | disclosed |
| CN-86106692-A | Olefines as sterilant | — | 1987-03-18 | — | — | CN | disclosed |