Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 13/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.67 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.67 |
| ▸ | PGR | P06401 | 3/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.67 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.67 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.67 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.67 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.67 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL9235990 | 0.93 | IDO1 (0.79) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL10004280 | 0.90 | IDO1 (0.65) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL10004903 | 0.88 | IDO1 (0.63) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL9235951 | 0.88 | IDO1 (0.67) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL28739418 | 0.86 | IDO1 (0.82) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| Nitric Acid SCHEMBL9007362 | 0.85 | CYP3A4 (0.82) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL11263940 | 0.83 | IDO1 (0.62) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL23031247 | 0.83 | IDO1 (0.65) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL11495874 | 0.82 | IDO1 (0.88) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 | |
| Econazole SCHEMBL7602993 | 0.81 | IDO1 (1.00) | IDO1CYP3A4CYP2C9CYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995006651-A1 | HYDROLYTICALLY STABLE PENTAERYTHRITOL DIPHOSPHITES | DOVER CHEMICAL CORPORATION (US) | 1995-03-09 | — | — | WO | claimed |
| EP-0666077-A1 | ANTI-MRSA COMPOSITION | MEIJI SEIKA KABUSHIKI KAISHA (JP) | 1995-08-09 | — | — | EP | disclosed |
| WO-1995006651-A1 | HYDROLYTICALLY STABLE PENTAERYTHRITOL DIPHOSPHITES | DOVER CHEMICAL CORPORATION (US) | 1995-03-09 | — | — | WO | disclosed |