Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 6/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 7/20 | 0.46 |
| ▸ | WNT1 | P04628 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | AXL | P30530 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22725003 | 0.89 | SMYD3 (0.49) | SMYD3 | |
| SCHEMBL22725148 | 0.84 | SMYD3 (0.49) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL21775939 | 0.81 | SMYD3 (0.46) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL20273808 | 0.79 | SMYD3 (0.44) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL3543086 | 0.77 | SMYD3 (0.46) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL2990215 | 0.75 | PRKAB2 (0.50) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL24150861 | 0.75 | SMYD3 (0.45) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL30379807 | 0.75 | SMYD3 (0.45) | SMYD3CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL20261972 | 0.74 | NPC1 (0.48) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL20273813 | 0.73 | IRAK4 (0.45) | SMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3336091-B1 | IRAK4 INHIBITOR AND USE THEREOF | BEIJING HANMI PHARMACEUTICAL CO LTD (CN) | 2020-12-02 | — | — | EP | disclosed |