Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 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 | |
|---|---|---|---|---|
| SCHEMBL13395651 | 0.83 | PTGS1 (0.32) | NPC1RAB9AATMERAP1GBA1 | |
| SCHEMBL13395664 | 0.79 | MAP3K5 (0.37) | NPC1RAB9AATM | |
| SCHEMBL13395139 | 0.71 | PTGS1 (0.34) | NPC1RAB9AATMERAP1 | |
| SCHEMBL12435847 | 0.70 | PARP1 (0.32) | NPC1RAB9AATMERAP1GBA1 | |
| SCHEMBL12678852 | 0.67 | NOTUM (0.37) | NPC1RAB9AATMERAP1 | |
| SCHEMBL12680389 | 0.67 | NOTUM (0.37) | NPC1RAB9AATMERAP1 | |
| SCHEMBL1725907 | 0.64 | PDPK1 (0.39) | — | |
| SCHEMBL13413392 | 0.63 | BTK (0.35) | — | |
| SCHEMBL1543810 | 0.61 | CYP3A4 (0.49) | — | |
| SCHEMBL2128431 | 0.61 | CYP3A4 (0.49) | — |
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-2008082484-A1 | 4,5-RING ANNULATED INDOLE DERIVATIVES FOR TREATING OR PREVENTING OF HCV AND RELATED VIRAL INFECTIONS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |