Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | MARK3 | P27448 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14347262 | 0.88 | CDC7 (0.48) | CDC7DYRK1ACDK5AURKADAPK3 | |
| SCHEMBL14374177 | 0.79 | DYRK1A (0.38) | CDC7DYRK1ACDK5AURKADAPK3 | |
| SCHEMBL14347292 | 0.73 | MAPT (0.56) | MAPK1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL14347278 | 0.72 | CYP1A1 (0.35) | DYRK1AHIPK2CLK1MAPK14KDM4E | |
| SCHEMBL14347279 | 0.72 | MAPT (0.42) | KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL14347562 | 0.71 | HTR2A (0.36) | DYRK1AHIPK2CLK1MAPK14ADORA3 | |
| SCHEMBL14347638 | 0.69 | AHR (0.44) | PARP1DAOKDM4EALDH1A1HPGD | |
| SCHEMBL12733329 | 0.69 | CYP3A4 (0.41) | DYRK1AHIPK2CLK1KDM4EHTT | |
| SCHEMBL14347584 | 0.68 | DAO (0.46) | DYRK1ACDK5PLK3PARP1CLK1 | |
| SCHEMBL25679865 | 0.66 | KIF11 (0.66) | DYRK1ACDK5AURKAPIM1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7312211-B2 | Pryanone compounds useful as reversible inhibitors of cysteine proteases | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2007-12-25 | — | — | US | disclosed |