Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4065586 | 0.89 | HSD11B1 (0.46) | HSD11B1CYP2D6CYP3A4TSHRHDAC2 | |
| SCHEMBL4064514 | 0.81 | CYP2D6 (0.40) | CYP2D6CYP3A4TSHRCYP1A2CYP2C19 | |
| SCHEMBL4069858 | 0.81 | HSD11B1 (0.40) | HSD11B1CYP2D6CYP3A4TSHRHDAC2 | |
| SCHEMBL3052320 | 0.79 | HSD11B1 (0.55) | HSD11B1KMT2A | |
| SCHEMBL25907682 | 0.79 | HSD11B1 (0.37) | HSD11B1CYP2D6HDAC2HDAC1ALDH1A1 | |
| SCHEMBL4065590 | 0.76 | HSD11B1 (0.40) | HSD11B1CYP2D6CYP3A4TSHRHDAC2 | |
| SCHEMBL4070867 | 0.75 | CYP3A4 (0.44) | CYP2D6CYP3A4TSHRCYP1A2CYP2C19 | |
| SCHEMBL23588941 | 0.74 | USP2 (0.40) | HSD11B1CYP2D6CYP3A4TSHRHDAC2 | |
| SCHEMBL21472213 | 0.73 | HSD11B1 (0.34) | HSD11B1CYP2D6HDAC2HDAC1CYP1A2 | |
| SCHEMBL25001376 | 0.73 | HSD11B1 (0.38) | HSD11B1CYP2D6CYP3A4TSHRHDAC2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2520568-B1 | Spirocyclic nitriles as inhibitors of protease | SANOFI SA (FR) | 2015-09-09 | — | — | EP | disclosed |
| 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 |