Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.37 |
| ▸ | WDR77 | Q9BQA1 | 3/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.34 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.34 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | VDR | P11473 | 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 | |
|---|---|---|---|---|
| SCHEMBL19086253 | 0.91 | KDM1A (0.41) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086222 | 0.86 | KDM1A (0.39) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086245 | 0.85 | HDAC6 (0.43) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19087005 | 0.84 | KDM1A (0.41) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086203 | 0.83 | PRMT5 (0.40) | KDM1AHDAC6PRMT5WDR77NAMPT | |
| SCHEMBL19086189 | 0.82 | PRMT5 (0.48) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086204 | 0.82 | ALDH1A1 (0.43) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086019 | 0.82 | ALDH1A1 (0.41) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086353 | 0.80 | HDAC6 (0.43) | KDM1AHDAC6PRMT5WDR77ALDH1A1 | |
| SCHEMBL19086017 | 0.80 | HDAC6 (0.36) | KDM1AHDAC6PRMT5WDR77NAMPT |
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 |