Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 11/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 11/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 11/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.35 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | MGAM | O43451 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | SI | P14410 | 3/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.33 |
| ▸ | CBFB | Q13951 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL1129265 | 0.81 | NPC1 (0.44) | NPC1RAB9ATLR9TLR8TLR7 | |
| SCHEMBL1192237 | 0.78 | NPC1 (0.50) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL1128497 | 0.76 | NPC1 (0.45) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL1128996 | 0.71 | NPC1 (0.44) | NPC1RAB9ALMNA | |
| SCHEMBL3109602 | 0.71 | MGAM (0.60) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL30166984 | 0.71 | MGAM (0.60) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL1128920 | 0.70 | NPC1 (0.46) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL3269250 | 0.69 | HSD17B10 (0.40) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL1128775 | 0.69 | LMNA (0.41) | NPC1RAB9ALMNA | |
| SCHEMBL23589101 | 0.68 | — | — |
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-2282762-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | Intermune, Inc. (US) | 2011-02-16 | — | — | EP | disclosed |
| WO-2009142842-A2 | NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION | INTERMUNE, INC. (US) | 2009-11-26 | — | — | WO | disclosed |