Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.33 |
| ▸ | TPH1 | P17752 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14223294 | 0.94 | NPC1 (0.37) | NPC1L3MBTL1IRAK4KDM4ENPSR1 | |
| SCHEMBL4731095 | 0.93 | S1PR1 (0.36) | NPC1L3MBTL1IRAK4S1PR1KDM4E | |
| SCHEMBL4728477 | 0.87 | SLC6A9 (0.35) | IRAK4SLC6A9 | |
| SCHEMBL14223018 | 0.87 | KDM4E (0.37) | NPC1L3MBTL1IRAK4S1PR1KDM4E | |
| SCHEMBL4730991 | 0.84 | APOBEC3A (0.33) | NPC1KDM4ELIMK1 | |
| SCHEMBL4730779 | 0.81 | IRAK4 (0.35) | NPC1L3MBTL1IRAK4SLC6A9 | |
| SCHEMBL4730446 | 0.80 | KDM4E (0.38) | NPC1KDM4ENPSR1KMT2A | |
| SCHEMBL4726527 | 0.80 | ALDH1A1 (0.39) | KDM4EMEN1KMT2A | |
| SCHEMBL4726531 | 0.80 | ALDH1A1 (0.39) | KDM4EMEN1KMT2A | |
| SCHEMBL4794177 | 0.79 | ALDH1A1 (0.37) | MEN1KMT2A |
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-2008043791-A2 | THIOPHENE DERIVATIVES FOR TREATING HEPATITIS C | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-17 | — | — | WO | claimed |
| WO-2008043791-A2 | THIOPHENE DERIVATIVES FOR TREATING HEPATITIS C | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |