Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.35 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.35 |
| ▸ | PRKX | P51817 | 1/20 | 0.35 |
| ▸ | NEK4 | P51957 | 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 | |
|---|---|---|---|---|
| SCHEMBL19086241 | 0.94 | HDAC6 (0.36) | HDAC6NPC1RAB9APRNPPRMT5 | |
| SCHEMBL19086219 | 0.92 | HDAC6 (0.36) | HDAC6NPC1RAB9APRNPPRMT5 | |
| SCHEMBL19086206 | 0.91 | HDAC6 (0.38) | HDAC6PRMT5WDR77KDM1AHCRTR2 | |
| SCHEMBL19086216 | 0.90 | HDAC6 (0.35) | HDAC6PRMT5WDR77KDM1AHCRTR2 | |
| SCHEMBL19086017 | 0.90 | HDAC6 (0.36) | HDAC6PRMT5WDR77KDM1A | |
| SCHEMBL19086335 | 0.88 | HDAC6 (0.39) | HDAC6PRMT5WDR77HCRTR2 | |
| SCHEMBL19086201 | 0.85 | PRMT5 (0.40) | HDAC6PRMT5WDR77GAA | |
| SCHEMBL19086194 | 0.84 | PRMT5 (0.43) | PRMT5WDR77HCRTR2 | |
| SCHEMBL19086009 | 0.84 | KMT2A (0.42) | PRMT5WDR77SMN1; SMN2HCRTR2 | |
| SCHEMBL19086006 | 0.83 | KDM4E (0.38) | HDAC6PRMT5WDR77SMN1; SMN2 |
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 |