Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7067350 | 1.00 | CYP19A1 (0.41) | CYP19A1SMN1; SMN2CES2CES1ESR1 | |
| SCHEMBL2200157 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2MAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL8032377 | 0.75 | ELANE (0.43) | CYP19A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL8032380 | 0.75 | ELANE (0.43) | CYP19A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL8022876 | 0.74 | CES2 (0.48) | SMN1; SMN2CES2CES1ESR1MAPT | |
| SCHEMBL7792871 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL13278304 | 0.73 | ALDH1A1 (0.41) | SMN1; SMN2MAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL27879907 | 0.71 | KMT2A (0.48) | SMN1; SMN2MAPTALDH1A1KMT2AMEN1 | |
| SCHEMBL9621956 | 0.71 | CES2 (0.42) | CYP19A1SMN1; SMN2CES2CES1ESR1 | |
| SCHEMBL6396731 | 0.71 | SMN1; SMN2 (0.48) | SMN1; SMN2MAPTALDH1A1KMT2AMEN1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0996614-B1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA (JP) | 2003-06-11 | — | — | EP | claimed |
| US-6187944-B1 | A PHENYL ACRYLONITRILE COMPOUNDS USEFUL AS ACTIVE INGREDIENTS OF AN INSECTICIDE, A MITICIDE, A NEMATICIDE, A SOIL PESTICIDE, A FUNGICIDE AND A MARINE ANTIFOULING AGENT | ISHIHARA SANGYO KAISHA LTD. (JP) | 2001-02-13 | — | — | US | claimed |
| EP-0996614-A1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2000-05-03 | — | — | EP | claimed |
| WO-1998035935-A1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA LTD. (JP) | 1998-08-20 | — | — | WO | claimed |
| EP-0996614-B1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA (JP) | 2003-06-11 | — | — | EP | disclosed |
| US-6187944-B1 | A PHENYL ACRYLONITRILE COMPOUNDS USEFUL AS ACTIVE INGREDIENTS OF AN INSECTICIDE, A MITICIDE, A NEMATICIDE, A SOIL PESTICIDE, A FUNGICIDE AND A MARINE ANTIFOULING AGENT | ISHIHARA SANGYO KAISHA LTD. (JP) | 2001-02-13 | — | — | US | disclosed |
| EP-0996614-A1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2000-05-03 | — | — | EP | disclosed |
| WO-1998035935-A1 | ACRYLONITRILE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM | ISHIHARA SANGYO KAISHA LTD. (JP) | 1998-08-20 | — | — | WO | disclosed |