Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.38 |
| ▸ | MEP1B | Q16820 | 4/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 4/20 | 0.36 |
| ▸ | APP | P05067 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23471251 | 0.89 | SPR (0.46) | SPRHSD17B10ROCK2ROCK1ALDH1A1 | |
| SCHEMBL19634806 | 0.88 | HSD17B10 (0.38) | SPRHSD17B10ERCC1ERCC4ALDH1A1 | |
| SCHEMBL23470998 | 0.86 | SPR (0.44) | SPRHSD17B10ROCK2ROCK1ALDH1A1 | |
| SCHEMBL23470986 | 0.84 | SPR (0.50) | SPRHSD17B10ROCK2ROCK1ALDH1A1 | |
| SCHEMBL19634698 | 0.83 | ERCC1 (0.41) | SPRHSD17B10ERCC1ERCC4ALDH1A1 | |
| SCHEMBL19634735 | 0.82 | ERCC1 (0.37) | HSD17B10ERCC1ERCC4MEP1BROCK2 | |
| SCHEMBL23470997 | 0.81 | HDAC3 (0.44) | MEP1BALDH1A1KMT2AHTTSMN1; SMN2 | |
| SCHEMBL19634399 | 0.80 | ERCC1 (0.44) | ERCC1ERCC4ALDH1A1NPC1KMT2A | |
| SCHEMBL21015966 | 0.79 | ERCC1 (0.41) | HSD17B10ERCC1ERCC4MEP1BROCK2 | |
| SCHEMBL23471280 | 0.78 | NR1H4 (0.43) | MEP1BALDH1A1NPC1KMT2APPARG |
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-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |