Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 1/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.34 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.34 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13684444 | 0.90 | ABCC9 (0.33) | ABCC9ABCC8KCNJ11KCNJ8NAMPT | |
| SCHEMBL13127925 | 0.81 | ALDH1A1 (0.46) | — | |
| SCHEMBL13686134 | 0.73 | MMP1 (0.35) | — | |
| SCHEMBL13686199 | 0.73 | CTSK (0.38) | ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL13686202 | 0.72 | MMP1 (0.32) | — | |
| SCHEMBL13684443 | 0.70 | ALDH1A1 (0.45) | — | |
| SCHEMBL13686144 | 0.69 | — | — | |
| SCHEMBL13686136 | 0.68 | — | — | |
| SCHEMBL13366951 | 0.64 | ALDH1A1 (0.52) | — | |
| SCHEMBL8165509 | 0.63 | MEN1 (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7592419-B2 | Macrocyclic inhibitors of hepatitis C virus NS3-serine protease | SCHERING CORPORATION (US) | 2009-09-22 | — | — | US | disclosed |