Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13756032 | 1.00 | CYP1A2 (0.62) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL10837120 | 0.98 | CYP1A2 (0.64) | CYP1A2GAAMGAMSIMGAM2 | |
| Hydrochloric Acid SCHEMBL26095448 | 0.96 | CYP1A2 (0.62) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL13756029 | 0.91 | CYP1A2 (0.66) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL13756031 | 0.90 | GAA (0.56) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL9774188 | 0.89 | CYP1A2 (0.63) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL4464939 | 0.88 | GAA (0.59) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL21896489 | 0.87 | CYP1A2 (0.61) | CYP1A2GAAMGAMSIMGAM2 | |
| SCHEMBL20937509 | 0.86 | LTA4H (0.52) | CYP1A2GAAMGAMSIMGAM2 | |
| Hydrochloric Acid SCHEMBL11851530 | 0.86 | GAA (0.56) | CYP1A2GAAMGAMSIMGAM2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |