Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | CCKBR | P32239 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 12/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9619732 | 0.72 | TAAR1 (0.42) | SLC6A3 | |
| SCHEMBL9619804 | 0.70 | TAAR1 (0.41) | SLC6A3 | |
| SCHEMBL5320974 | 0.64 | CYP11B1 (0.80) | MLNRNR1I2ADORA3TBXA2RCCKBR | |
| SCHEMBL5437850 | 0.64 | CYP11B1 (0.80) | MLNRNR1I2ADORA3TBXA2RCCKBR | |
| SCHEMBL19441058 | 0.63 | TAAR1 (0.50) | SLC6A3 | |
| SCHEMBL11700678 | 0.61 | CYP3A4 (0.45) | NR1I2OPRK1KCNH2CYP17A1CYP11B1 | |
| SCHEMBL13017111 | 0.61 | CYP11B1 (0.68) | CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL9619807 | 0.60 | TAAR1 (0.47) | — | |
| SCHEMBL10941498 | 0.60 | CYP19A1 (0.51) | CYP17A1CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL9619923 | 0.59 | TAAR1 (0.50) | — |
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 |