Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 16/20 | 0.63 |
| ▸ | USP2 | O75604 | 11/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.61 |
| ▸ | TSHR | P16473 | 5/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | HBB | P68871 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL485229 | 0.92 | CYP3A4 (0.63) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL23439556 | 0.85 | CYP3A4 (0.58) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL4072452 | 0.84 | CYP3A4 (0.55) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL23411518 | 0.83 | CYP3A4 (0.55) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL23439910 | 0.82 | CYP3A4 (0.67) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL632352 | 0.81 | L3MBTL1 (0.73) | ALDH1A1MAPK1SMN1; SMN2L3MBTL1 | |
| SCHEMBL23412145 | 0.78 | ADRB1 (0.61) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL484916 | 0.78 | ITGB3 (0.68) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL485392 | 0.78 | CYP11B2 (0.54) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 | |
| SCHEMBL23440345 | 0.78 | CTSB (0.51) | CYP3A4USP2CYP2C9ALDH1A1CYP2C19 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2032535-B1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI SA (FR) | 2012-08-01 | — | — | EP | claimed |
| EP-2032535-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | Sanofi-Aventis (FR) | 2009-03-11 | — | — | EP | claimed |
| WO-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | claimed |
| EP-2520568-A1 | Spirocyclic nitriles as inhibitors of protease | SANOFI (FR) | 2012-11-07 | — | — | EP | disclosed |
| EP-2032535-B1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI SA (FR) | 2012-08-01 | — | — | EP | disclosed |
| EP-2032535-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | Sanofi-Aventis (FR) | 2009-03-11 | — | — | EP | disclosed |
| WO-2007137738-A1 | SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS | SANOFI-AVENTIS (DE) | 2007-12-06 | — | — | WO | disclosed |