Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 11/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 11/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6124828 | 0.90 | HDAC1 (0.35) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL7941871 | 0.90 | HDAC1 (0.35) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL13071545 | 0.90 | HDAC1 (0.39) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL6124816 | 0.88 | F2 (0.44) | ITGB3ITGA2BHDAC1HDAC4F2 | |
| SCHEMBL6124800 | 0.87 | HDAC1 (0.36) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL10166392 | 0.87 | HDAC1 (0.35) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL6124752 | 0.86 | HDAC1 (0.36) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL8274191 | 0.84 | HDAC1 (0.35) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL8273133 | 0.84 | HDAC1 (0.41) | ITGB3ITGA2BHDAC1HDAC8HDAC4 | |
| SCHEMBL13436021 | 0.81 | F2 (0.43) | ITGB3ITGA2BHDAC1HDAC4F2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009142842-A9 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2010-11-25 | — | — | WO | disclosed |
| WO-2009142842-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2009-11-26 | — | — | WO | disclosed |