Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.42 |
| ▸ | PRMT5 | O14744 | 5/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 5/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086242 | 0.91 | KDM1A (0.41) | KDM1APRMT5WDR77HDAC6ALDH1A1 | |
| SCHEMBL19086261 | 0.89 | PRMT5 (0.41) | KDM1APRMT5WDR77HDAC6ALDH1A1 | |
| SCHEMBL19086213 | 0.88 | KDM1A (0.40) | KDM1APRMT5WDR77HDAC6ALDH1A1 | |
| SCHEMBL19086987 | 0.87 | KDM1A (0.38) | KDM1APRMT5WDR77HDAC6 | |
| SCHEMBL19086335 | 0.85 | HDAC6 (0.39) | PRMT5WDR77HDAC6POLBTDP1 | |
| SCHEMBL19086211 | 0.84 | PRMT5 (0.42) | KDM1APRMT5WDR77ALDH1A1GAA | |
| SCHEMBL19086244 | 0.83 | HCRTR2 (0.39) | KDM1APRMT5WDR77HDAC6ALDH1A1 | |
| SCHEMBL19086982 | 0.83 | KDM1A (0.37) | KDM1APRMT5WDR77HDAC6 | |
| SCHEMBL19086004 | 0.82 | PRMT5 (0.39) | KDM1APRMT5WDR77HDAC6 | |
| SCHEMBL19087006 | 0.82 | PRMT5 (0.38) | KDM1APRMT5WDR77HDAC6 |
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-2017114275-A1 | COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME | 成都先导药物开发有限公司 | 2017-07-06 | — | — | WO | disclosed |