Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.37 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | CCR4 | P51679 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3510172 | 0.95 | ACACB (0.44) | ACACBHCRTR1HCRTR2CDK1CDK2 | |
| SCHEMBL3510673 | 0.85 | CDK1 (0.46) | CDK1CDK2AOC3SUV39H2DYRK1A | |
| SCHEMBL3509223 | 0.74 | CA12 (0.45) | HCRTR1HCRTR2TSHRLMNAALDH1A1 | |
| SCHEMBL20075911 | 0.72 | CA12 (0.49) | CDK2LMNA | |
| SCHEMBL31402767 | 0.72 | SMO (0.42) | CDK1CDK2AOC3SUV39H2CNR2 | |
| SCHEMBL31402759 | 0.72 | SMO (0.42) | CDK1CDK2AOC3SUV39H2CNR2 | |
| SCHEMBL3511418 | 0.72 | SMO (0.42) | CDK1CDK2AOC3SUV39H2CNR2 | |
| SCHEMBL15650136 | 0.72 | CDK1 (0.47) | CDK1CDK2AOC3SUV39H2DYRK1A | |
| SCHEMBL15650137 | 0.72 | CDK1 (0.47) | CDK1CDK2AOC3SUV39H2DYRK1A | |
| SCHEMBL30422629 | 0.71 | PDE10A (0.49) | ACACBHCRTR1HCRTR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2166846-A1 | INHIBITORS OF JANUS KINASES | Merck Sharp & Dohme Corp. (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008156726-A1 | INHIBITORS OF JANUS KINASES | MERCK & CO., INC. (US) | 2008-12-24 | — | — | WO | disclosed |