Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.38 |
| ▸ | FLT4 | P35916 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL283639 | 0.80 | IDO1 (0.62) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| Methyl Alcohol SCHEMBL21223343 | 0.78 | MAPK1 (0.59) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL4163742 | 0.78 | IDO1 (0.60) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL10581269 | 0.78 | IDO1 (0.60) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| Trimethylammonium SCHEMBL11564446 | 0.76 | IDO1 (0.54) | IDO1CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL29393025 | 0.76 | KMT2A (0.48) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7039692 | 0.76 | KMT2A (0.48) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL11319360 | 0.75 | CES2 (0.48) | KDM4EKMT2ATDP1 | |
| SCHEMBL12411263 | 0.75 | CES2 (0.48) | KDM4EKMT2ATDP1 | |
| 1,2-Dichlorobenzene SCHEMBL11813576 | 0.72 | IDO1 (0.54) | IDO1CYP1A2CYP2C19CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5336671-A | Fungicidal compositions containing benzyl-tris(aryl)phosphonium salts | SHELL RESEARCH LIMITED (GB) | 1994-08-09 | — | — | US | disclosed |
| EP-0453580-A1 | Fungicidal benzyl-tris(aryl)-phosphonium salts | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-10-30 | — | — | EP | disclosed |
| WO-1991013073-A1 | FUNGICIDAL COMPOSITIONS CONTAINING BENZYL-TRIS(ARYL)PHOSPHONIUM SALTS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1991-09-05 | — | — | WO | disclosed |
| EP-0444749-A1 | Fungicidal compositions containing benzyl-tris(aryl) phosphonium salts | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-09-04 | — | — | EP | disclosed |