Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22685075 | 0.92 | IDO1 (0.43) | HDAC6PTPN1MAP4K4CHEK2HDAC3 | |
| SCHEMBL22685250 | 0.91 | PTPN1 (0.40) | ROCK2ROCK1HDAC6PTPN1HDAC3 | |
| SCHEMBL22685264 | 0.89 | PDE2A (0.42) | ROCK2ROCK1HDAC6MAP4K4CHEK2 | |
| SCHEMBL22685245 | 0.85 | MAP4K4 (0.41) | MAP4K4DEGS1PDE2AIDO1CYP2C9 | |
| SCHEMBL22685329 | 0.82 | IDO1 (0.43) | ROCK2ROCK1HDAC6MAP4K4HDAC3 | |
| SCHEMBL22685074 | 0.80 | IDO1 (0.51) | HDAC6MAP4K4HDAC3HDAC1HDAC2 | |
| SCHEMBL22685249 | 0.80 | WDR91 (0.41) | ROCK2ROCK1HDAC6MAP4K4HDAC3 | |
| SCHEMBL22685078 | 0.80 | WDR91 (0.53) | MAP4K4F10PDE2AIDO1CYP2C9 | |
| SCHEMBL22685072 | 0.80 | IDO1 (0.43) | HDAC6HDAC3HDAC1HDAC2PDE2A | |
| SCHEMBL22685187 | 0.79 | PDE2A (0.44) | ROCK2ROCK1HDAC6HDAC3HDAC1 |
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-2020228823-A1 | NOVEL AMIDE COMPOUNDS AND USES THEREOF | HUTCHISON MEDIPHARMA LIMITED (CN) | 2020-11-19 | — | — | WO | disclosed |