Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 17/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3461135 | 0.72 | PIK3CD (0.47) | CNR2HDAC4HDAC6 | |
| SCHEMBL3873902 | 0.72 | HDAC4 (0.41) | CNR2HDAC4HDAC6 | |
| SCHEMBL3873907 | 0.65 | CNR2 (0.34) | CNR2HDAC6CNR1AOC3 | |
| SCHEMBL20043166 | 0.65 | CNR2 (0.48) | CNR2HDAC4HDAC6CNR1 | |
| SCHEMBL14349571 | 0.62 | NPC1 (0.50) | CNR2 | |
| SCHEMBL2678063 | 0.62 | DPP4 (0.38) | AOC3 | |
| SCHEMBL29625962 | 0.62 | HDAC6 (0.60) | HDAC4HDAC6 | |
| SCHEMBL16115983 | 0.61 | CNR2 (0.65) | CNR2CNR1 | |
| Hydrochloric Acid SCHEMBL23114008 | 0.60 | DPP4 (0.37) | — | |
| SCHEMBL16543467 | 0.59 | RAB9A (0.61) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501514-A4 | PROTEIN KINASE MODULATORS AND METHODS OF USE | EXELIXIS INC (US) | 2009-08-26 | — | — | EP | disclosed |
| EP-1501514-A2 | PROTEIN KINASE MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003093297-A2 | PROTEIN KINASE MODULATORS AND METHODS OF USE | EXELIXIS, INC. (US) | 2003-11-13 | — | — | WO | disclosed |