Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.41 |
| ▸ | CTSL | P07711 | 2/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | PREP | P48147 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14584270 | 1.00 | CA1 (0.50) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL13622634 | 1.00 | CA1 (0.50) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL8283591 | 0.86 | PIK3CD (0.45) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL13622668 | 0.86 | PIK3CD (0.45) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL16119379 | 0.85 | PIK3CD (0.44) | PIK3CDCTSKCTSLCTSBTSHR | |
| SCHEMBL16228401 | 0.85 | PIK3CD (0.44) | PIK3CDCTSKCTSLCTSBTSHR | |
| SCHEMBL30489476 | 0.83 | PIK3CD (0.39) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL24189108 | 0.82 | PIK3CD (0.44) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL24189127 | 0.82 | PIK3CD (0.44) | CA1CA2CA7PIK3CDCTSK | |
| SCHEMBL24189152 | 0.82 | PIK3CD (0.44) | CA1CA2CA7PIK3CDCTSK |
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-1730142-B1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORP (US) | 2011-06-29 | — | — | EP | disclosed |
| WO-2005085242-A1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORPORATION (US) | 2005-09-15 | — | — | WO | disclosed |