Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.44 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.37 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1293407 | 0.87 | HSD17B1 (0.46) | HSD17B1ADORA3SCN7AKCNH2SCN9A | |
| SCHEMBL1293774 | 0.77 | GSK3B (0.50) | SMN1; SMN2LRRK2HSD17B14 | |
| SCHEMBL27954240 | 0.77 | AKR1C3 (0.36) | SCN9ACYP1A2 | |
| SCHEMBL27870954 | 0.76 | SMN1; SMN2 (0.56) | HSD17B1ADORA3MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL12520183 | 0.76 | HSD17B14 (0.51) | MAPTSMN1; SMN2ALDH1A1GAAKMT2A | |
| SCHEMBL27887111 | 0.75 | BACE1 (0.46) | SMN1; SMN2L3MBTL1ALDH1A1GAACYP1A2 | |
| SCHEMBL26803625 | 0.75 | MEN1 (0.46) | KCNH2MAPTSMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL1758972 | 0.74 | HSD17B1 (0.41) | HSD17B1ADORA3MAPTSMN1; SMN2KIF11 | |
| SCHEMBL16974295 | 0.73 | AAK1 (0.53) | ALDH1A1MAP4K4CLK4LRRK2 | |
| SCHEMBL28427073 | 0.73 | MAPT (0.70) | HSD17B1ADORA3MAPTSMN1; SMN2L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102712623-B | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2014-04-02 | — | — | CN | disclosed |
| CN-102712623-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2012-10-03 | — | — | CN | disclosed |
| CN-102686565-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2012-09-19 | — | — | CN | disclosed |