Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TACR1 | P25103 | 1/20 | 0.30 |
| ▸ | POLQ | O75417 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9619684 | 0.95 | TAAR1 (0.39) | TAAR1ALDH1A1TSHRIDO1TACR1 | |
| Isothiocyanate SCHEMBL9619888 | 0.88 | TAAR1 (0.34) | TAAR1ALDH1A1TSHR | |
| SCHEMBL9619890 | 0.88 | TAAR1 (0.34) | TAAR1ALDH1A1TSHRPOLQ | |
| Hydrochloric Acid SCHEMBL9619710 | 0.70 | TAAR1 (0.39) | TAAR1ALDH1A1IDO1 | |
| Hydrochloric Acid SCHEMBL9619927 | 0.70 | TAAR1 (0.39) | TAAR1 | |
| SCHEMBL9619846 | 0.70 | KIF11 (0.41) | TAAR1ALDH1A1TSHRIDO1TACR1 | |
| Bromide SCHEMBL10624508 | 0.70 | PPARG (0.38) | TAAR1ALDH1A1IDO1 | |
| Fluoride SCHEMBL9620011 | 0.69 | KIF11 (0.40) | TAAR1ALDH1A1TSHRIDO1TACR1 | |
| Bromide SCHEMBL9619761 | 0.69 | KIF11 (0.40) | TAAR1ALDH1A1TSHRIDO1TACR1 | |
| Fluoride SCHEMBL9619810 | 0.69 | TAAR1 (0.48) | TAAR1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0214842-B1 | ORGANOTIN COMPOUNDS AND PESTICIDES CONTAINING THEM | SHIONOGI & CO., LTD. (JP) | 1992-02-05 | — | — | EP | disclosed |
| US-4935408-A | Organotin compounds and pesticides containing them | SHIONOGI & CO., LTD. (JP) | 1990-06-19 | — | — | US | disclosed |
| US-4774235-A | MITICIDES | SHIONOGI & CO., LTD. (JP) | 1988-09-27 | — | — | US | disclosed |
| EP-0214842-A2 | Organotin compounds and pesticides containing them | SHIONOGI & CO., LTD. (JP) | 1987-03-18 | — | — | EP | disclosed |