Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | MC1R | Q01726 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA9 | Q16790 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.45 |
| ▸ | MC4R | P32245 | 1/20 | 0.44 |
| ▸ | MC5R | P33032 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | MPO | P05164 | 4/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL18575559 | 0.85 | CA12 (0.54) | MC1RCA12CA2CA9KDM4E | |
| SCHEMBL19233358 | 0.82 | CA12 (0.45) | TAAR1CA12CA2CA9KDM4E | |
| SCHEMBL11265581 | 0.80 | MAOA (0.44) | TAAR1CA12CA2CA9KDM4E | |
| SCHEMBL30192689 | 0.79 | CA12 (0.48) | MC1RCA12CA2CA9KDM4E | |
| SCHEMBL4706607 | 0.78 | CHRM2 (0.71) | TAAR1CA12CA2CA9KDM4E | |
| SCHEMBL7245746 | 0.78 | MPO (0.62) | TAAR1CA12CA2CA9MPO | |
| SCHEMBL3985527 | 0.77 | MPO (0.64) | MPO | |
| SCHEMBL2549012 | 0.76 | CA12 (0.78) | TAAR1CA12CA2CA9KDM4E | |
| SCHEMBL5547862 | 0.76 | CA12 (0.46) | MC1RCA12CA2CA9KDM4E | |
| Hydrochloric Acid SCHEMBL4707535 | 0.76 | CHRM2 (0.69) | TAAR1CA12CA2CA9KDM4E |
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-4315846-A | FUNGICIDES | TOKYO ORGANIC CHEMICAL INDUSTRIES, LTD. (JP) | 1982-02-16 | — | — | US | disclosed |
| EP-0037861-A1 | Salts of alkylenebisdithiocarbamic acid derivatives, processes for their preparation, fungicidal compositions containing them and methods of combating fungi | TOKYO ORGANIC CHEMICAL INDUSTRIES, LTD. (JP) | 1981-10-21 | — | — | EP | disclosed |