Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | BLM | P54132 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.55 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.54 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28949025 | 1.00 | CNR1 (0.57) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL22319405 | 0.94 | CNR1 (0.56) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL5529572 | 0.85 | EPHX2 (0.68) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL18157870 | 0.85 | EPHX2 (0.68) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL5529570 | 0.85 | EPHX2 (0.68) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL29986579 | 0.85 | EPHX2 (0.66) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL20564617 | 0.84 | PPARA (0.43) | CNR1ALDH1A1HPGDTRPV1EPHX2 | |
| SCHEMBL31006431 | 0.84 | CNR1 (0.65) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL27500925 | 0.84 | CNR1 (0.63) | CNR1ALDH1A1HPGDTRPV1MEN1 | |
| SCHEMBL30211894 | 0.83 | FAAH (0.50) | TRPV1MEN1BLMKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4851139-A | 4-ISOTHIAZOLIN-3-ONE AND SOLVENT | THE CLOROX COMPANY (US) | 1989-07-25 | — | — | US | disclosed |
| EP-0305065-A2 | Isotropic fabric softener composition containing fabric mildewstat | The Clorox Company (US) | 1989-03-01 | — | — | EP | disclosed |