Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18440245 | 0.81 | SIGMAR1 (0.54) | SIGMAR1IDO1 | |
| SCHEMBL6542312 | 0.79 | SIGMAR1 (0.56) | SIGMAR1IDO1 | |
| SCHEMBL10785005 | 0.79 | SIGMAR1 (0.60) | SIGMAR1IDO1 | |
| SCHEMBL29357487 | 0.78 | IDO1 (0.57) | SIGMAR1IDO1OPRM1 | |
| SCHEMBL145977 | 0.78 | IDO1 (0.57) | SIGMAR1IDO1OPRM1 | |
| SCHEMBL30285859 | 0.78 | SIGMAR1 (0.63) | SIGMAR1IDO1 | |
| SCHEMBL4661810 | 0.78 | SIGMAR1 (0.63) | SIGMAR1IDO1 | |
| SCHEMBL6542145 | 0.78 | SIGMAR1 (0.63) | SIGMAR1IDO1 | |
| SCHEMBL21924071 | 0.78 | SIGMAR1 (0.63) | SIGMAR1IDO1 | |
| SCHEMBL10988469 | 0.77 | SIGMAR1 (0.50) | SIGMAR1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0176294-B1 | CYCLOHEXANE-1,3-DIONE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PROCESSES FOR PREPARING THEM, AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS | ICI AUSTRALIA LIMITED (AU) | 1991-06-05 | — | — | EP | disclosed |
| US-4639267-A | Herbicidal cyclohexane-1,3-dione derivatives | ICI AUSTRALIA LIMITED (AU) | 1987-01-27 | — | — | US | disclosed |
| EP-0176294-A1 | Cyclohexane-1,3-dione derivatives, compositions containing them, processes for preparing them, and their use as herbicides and plant growth regulators | ICI AUSTRALIA LIMITED (AU) | 1986-04-02 | — | — | EP | disclosed |