Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | GCKR | Q14397 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.33 |
| ▸ | FEN1 | P39748 | 4/20 | 0.33 |
| ▸ | LIPE | Q05469 | 2/20 | 0.33 |
| ▸ | SPR | P35270 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 3/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650381 | 0.86 | ROCK2 (0.38) | ROCK2GPR119LIPEMMP1KDM4D | |
| SCHEMBL22650408 | 0.81 | PDK2 (0.36) | ROCK2GPR119JAK2JAK1JAK3 | |
| SCHEMBL22650588 | 0.81 | AKR1C3 (0.36) | ROCK2GCKGCKRCDK4PIK3CA | |
| SCHEMBL22650383 | 0.80 | FPR2 (0.35) | ROCK2LIPEKDM4DHTR2AHTR2C | |
| SCHEMBL23104497 | 0.80 | RET (0.45) | ALOX5APFEN1SPRJAK2JAK1 | |
| SCHEMBL29736351 | 0.80 | RET (0.45) | ALOX5APFEN1SPRJAK2JAK1 | |
| SCHEMBL29491165 | 0.80 | SPR (0.38) | ROCK2GPR119SPRJAK2JAK1 | |
| SCHEMBL23104405 | 0.80 | RET (0.45) | ALOX5APFEN1SPRJAK2JAK1 | |
| SCHEMBL22650412 | 0.80 | SPR (0.38) | ROCK2GPR119SPRJAK2JAK1 | |
| SCHEMBL30700827 | 0.78 | AAK1 (0.43) | GCKGCKRGPR119JAK2JAK1 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |