Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.31 |
| ▸ | DUT | P33316 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12599691 | 0.89 | DGAT1 (0.33) | KLKB1NPC1DGAT1 | |
| SCHEMBL12566360 | 0.86 | DGAT1 (0.34) | KLKB1NPC1DGAT1DUT | |
| SCHEMBL1077155 | 0.82 | NPC1 (0.33) | KLKB1NPC1DGAT1DUT | |
| SCHEMBL12600504 | 0.79 | KLKB1 (0.36) | KLKB1NPC1DGAT1 | |
| SCHEMBL30285593 | 0.78 | NPC1 (0.41) | KLKB1NPC1 | |
| SCHEMBL12567426 | 0.78 | DGAT1 (0.34) | NPC1DGAT1 | |
| SCHEMBL12566362 | 0.77 | DGAT1 (0.33) | NPC1DGAT1 | |
| SCHEMBL16382758 | 0.76 | DGAT1 (0.34) | NPC1DGAT1DUT | |
| SCHEMBL25755855 | 0.76 | NOTUM (0.49) | KLKB1NPC1DGAT1DUT | |
| SCHEMBL17699642 | 0.75 | NPC1 (0.39) | NPC1DGAT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011075607-A1 | NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2011-06-23 | — | — | WO | disclosed |