Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 19/20 | 0.49 |
| ▸ | CDK2 | P24941 | 6/20 | 0.47 |
| ▸ | KDR | P35968 | 5/20 | 0.47 |
| ▸ | JAK2 | O60674 | 3/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.47 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
| ▸ | TYK2 | P29597 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29722778 | 0.82 | EGFR (0.49) | EGFRCDK2KDRJAK2AURKB | |
| SCHEMBL15740461 | 0.82 | EGFR (0.49) | EGFRCDK2KDRJAK2AURKB | |
| SCHEMBL14283205 | 0.79 | KDM4E (0.51) | EGFR | |
| SCHEMBL21768448 | 0.77 | ACHE (0.46) | CDK2 | |
| SCHEMBL18813975 | 0.76 | EGFR (0.61) | EGFRCDK2KDRJAK2AURKB | |
| SCHEMBL24962265 | 0.76 | HTR3A (0.53) | CDK2 | |
| SCHEMBL25686263 | 0.74 | AOC3 (0.50) | EGFRCDK2KDRJAK2AURKB | |
| SCHEMBL3896595 | 0.72 | PIK3CA (0.54) | CDK2 | |
| SCHEMBL15740549 | 0.72 | EGFR (0.40) | EGFRCDK2KDRJAK2AURKB | |
| SCHEMBL17547159 | 0.72 | ACHE (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014081718-A1 | AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF T790M CONTAINING EGFR MUTANTS | GENENTECH, INC. (US) | 2014-05-30 | — | — | WO | disclosed |