Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 6/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7073002 | 1.00 | GABRA1 (0.41) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7066549 | 0.82 | MGLL (0.45) | GRIK1SLC22A12NPC1MGLLMAPT | |
| SCHEMBL7066546 | 0.82 | MGLL (0.45) | GRIK1SLC22A12NPC1MGLLMAPT | |
| SCHEMBL7070123 | 0.80 | KDM4E (0.40) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7070530 | 0.80 | KDM4E (0.40) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7071641 | 0.78 | SLC22A12 (0.38) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7071645 | 0.78 | SLC22A12 (0.38) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7073093 | 0.77 | SLC22A12 (0.36) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7073097 | 0.77 | SLC22A12 (0.36) | GABRA1GABRG2GABRB3GABRB2GABRB1 | |
| SCHEMBL7073487 | 0.74 | SLC22A12 (0.35) | GABRA1GABRG2GABRB3GABRB2GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |