Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK4 | O96013 | 2/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 9/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | BCL9 | O00512 | 2/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 4/20 | 0.41 |
| ▸ | RARG | P13631 | 4/20 | 0.41 |
| ▸ | RARA | P10276 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19066902 | 0.90 | PAK4 (0.48) | PAK4NAMPTPAK1HTR1AADRA1A | |
| SCHEMBL19066899 | 0.87 | BCL9 (0.52) | PAK4NAMPTPAK1HTR1ABCL9 | |
| SCHEMBL19066856 | 0.87 | PAK4 (0.45) | PAK4NAMPTPAK1HTR1AADRA1A | |
| SCHEMBL19066868 | 0.83 | PAK4 (0.48) | PAK4NAMPTPAK1HTR1AADRA1A | |
| SCHEMBL18529797 | 0.81 | PAK4 (0.42) | PAK4NAMPTPAK1HTR1AADRA1A | |
| SCHEMBL19079064 | 0.81 | NAMPT (0.56) | PAK4NAMPTPAK1HTR1ABCL9 | |
| SCHEMBL19066905 | 0.81 | NAMPT (0.46) | PAK4NAMPTPAK1HDAC1 | |
| SCHEMBL18529796 | 0.79 | BCL9 (0.44) | PAK4NAMPTPAK1HTR1ABCL9 | |
| SCHEMBL18529800 | 0.79 | PAK4 (0.40) | PAK4NAMPTPAK1HTR1AADRA1A | |
| SCHEMBL18530576 | 0.78 | SLC6A4 (0.46) | PAK4NAMPTPAK1KDM4EHDAC3 |
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-2017117447-A1 | MULTICYCLIC COMPOUNDS AND USES THEREOF | Karyopharm Therapeutics Inc. (US) | 2017-07-06 | — | — | WO | disclosed |