Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11138769 | 0.88 | ATM (0.54) | SMN1; SMN2CYP17A1ATMCYP11B1CYP11B2 | |
| SCHEMBL27306420 | 0.84 | ATM (0.59) | SMN1; SMN2CYP17A1ATMCYP11B1CYP11B2 | |
| SCHEMBL11134954 | 0.83 | SMN1; SMN2 (0.49) | SMN1; SMN2CYP17A1ATMLMNAHPGD | |
| SCHEMBL28001042 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2CYP17A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL30476558 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2CYP17A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL30476552 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2CYP17A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL477393 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2CYP17A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL477633 | 0.80 | SMN1; SMN2 (1.00) | SMN1; SMN2CYP17A1CFTRSLC6A2SLC6A4 | |
| Diphenylmethanol SCHEMBL6434457 | 0.80 | SMN1; SMN2 (0.61) | SMN1; SMN2L3MBTL1LMNACA12CA1 | |
| Diphenylmethanol SCHEMBL41571 | 0.80 | SMN1; SMN2 (0.61) | SMN1; SMN2L3MBTL1LMNACA12CA1 |
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-2252296-A1 | 3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | Wyeth LLC (US) | 2010-11-24 | — | — | EP | disclosed |
| WO-2009091788-A1 | 3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | WYETH (US) | 2009-07-23 | — | — | WO | disclosed |