Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 2/20 | 0.41 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.36 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28435575 | 0.98 | BBOX1 (0.42) | BBOX1SPHK2SPHK1CHRNB4CHRNA3 | |
| SCHEMBL7938662 | 0.84 | BBOX1 (0.48) | BBOX1SPHK2SPHK1CHRNB4CHRNA3 | |
| SCHEMBL21837354 | 0.84 | BBOX1 (0.48) | BBOX1SPHK2SPHK1CHRNB4CHRNA3 | |
| Bromide SCHEMBL16411893 | 0.83 | DNM1 (0.46) | BBOX1SPHK2SPHK1DNM1 | |
| Water SCHEMBL21837351 | 0.82 | BBOX1 (0.47) | BBOX1SPHK2SPHK1CHRNB4CHRNA3 | |
| SCHEMBL1356921 | 0.82 | BBOX1 (0.47) | BBOX1SPHK2SPHK1CYP1A2DNM1 | |
| Water SCHEMBL21837356 | 0.82 | BBOX1 (0.47) | BBOX1SPHK2SPHK1CHRNB4CHRNA3 | |
| SCHEMBL10438442 | 0.80 | BBOX1 (0.46) | BBOX1SPHK2SPHK1DNM1 | |
| SCHEMBL10438371 | 0.80 | BBOX1 (0.46) | BBOX1SPHK2SPHK1DNM1 | |
| SCHEMBL10438439 | 0.80 | BBOX1 (0.46) | BBOX1SPHK2SPHK1DNM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116251620-A | CHA zeolite and method for producing same | 东曹株式会社 | 2023-06-13 | — | — | CN | disclosed |
| CN-109195911-B | CHA-type zeolite and method for producing same | 东曹株式会社 | 2023-04-07 | — | — | CN | disclosed |
| CN-109195911-A | CHA-type zeolite and method for producing same | 东曹株式会社 | 2019-01-11 | — | — | CN | disclosed |