Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4486661 | 0.95 | MAPK14 (0.43) | XDHMAPK14ABL1BCR | |
| Pivalamide SCHEMBL5178016 | 0.93 | MAPK14 (0.41) | XDHMAPK14MAPK11ABL1BCR | |
| SCHEMBL5179484 | 0.89 | ABL1 (0.38) | MAPK14MAPK11ABL1BCR | |
| SCHEMBL5178018 | 0.89 | MAPK14 (0.41) | XDHMAPK14MAPK11ABL1BCR | |
| SCHEMBL4491863 | 0.85 | ABL1 (0.41) | MAPK14MAPK11ABL1BCR | |
| SCHEMBL5176158 | 0.84 | MAPK14 (0.39) | MAPK14 | |
| SCHEMBL4478482 | 0.84 | ABL1 (0.41) | MAPK14MAPK11ABL1BCR | |
| SCHEMBL5176650 | 0.82 | BRAF (0.45) | MAPK14 | |
| Pivalamide SCHEMBL5179479 | 0.82 | ABL1 (0.39) | MAPK14MAPK11ABL1BCR | |
| SCHEMBL4467266 | 0.82 | MAPK14 (0.41) | MAPK14 |
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-1756065-A1 | ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005115991-A1 | ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2005-12-08 | — | — | WO | disclosed |