Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 6/20 | 0.35 |
| ▸ | CCND1 | P24385 | 6/20 | 0.35 |
| ▸ | CCND3 | P30281 | 6/20 | 0.35 |
| ▸ | CDK6 | Q00534 | 6/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.35 |
| ▸ | CDK9 | P50750 | 3/20 | 0.35 |
| ▸ | CDK7 | P50613 | 2/20 | 0.35 |
| ▸ | CCNH | P51946 | 2/20 | 0.35 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.33 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 3/20 | 0.31 |
| ▸ | JAK1 | P23458 | 3/20 | 0.31 |
| ▸ | TYK2 | P29597 | 3/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16423007 | 0.84 | CDK4 (0.35) | CDK4CCND1CCND3CDK6CCNT1 | |
| SCHEMBL16423457 | 0.80 | TYK2 (0.48) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL15336761 | 0.74 | KDR (0.46) | CDK4CCND1CCND3JAK2JAK1 | |
| SCHEMBL15336851 | 0.71 | LRRK2 (0.42) | CDK4CCND1CCND3CDK6CCNT1 | |
| SCHEMBL16606006 | 0.71 | JAK2 (0.48) | JAK2JAK1TYK2JAK3 | |
| Hydrochloric Acid SCHEMBL16423487 | 0.70 | JAK2 (0.48) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL15336857 | 0.70 | TYK2 (0.50) | CDK4CCND1CCND3CDK6CCNT1 | |
| SCHEMBL16606007 | 0.69 | SYK (0.47) | CDK4CDK5JAK2TYK2ALK | |
| SCHEMBL15336850 | 0.69 | SCN9A (0.44) | CDK4CCND1CCND3CDK6CCNT1 | |
| SCHEMBL15336856 | 0.69 | CDK4 (0.52) | CDK4CCND1CCND3CDK6CCNT1 |
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-2832734-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2015-02-04 | — | — | EP | disclosed |