Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.49 |
| ▸ | ITK | Q08881 | 5/20 | 0.49 |
| ▸ | SYK | P43405 | 6/20 | 0.44 |
| ▸ | BTK | Q06187 | 3/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | LYN | P07948 | 1/20 | 0.44 |
| ▸ | TEC | P42680 | 1/20 | 0.44 |
| ▸ | TXK | P42681 | 1/20 | 0.44 |
| ▸ | BMX | P51813 | 1/20 | 0.44 |
| ▸ | JAK3 | P52333 | 1/20 | 0.44 |
| ▸ | CD69 | Q07108 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CCND2 | P30279 | 1/20 | 0.40 |
| ▸ | CCND3 | P30281 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17242396 | 0.97 | EGFR (0.46) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL17242380 | 0.86 | EGFR (0.50) | EGFRITKBTKJAK2LYN | |
| SCHEMBL17252102 | 0.85 | EGFR (0.61) | EGFRITKBTKJAK2LYN | |
| SCHEMBL17242422 | 0.85 | NPC1 (0.41) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL17242449 | 0.84 | EGFR (0.43) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL17242472 | 0.82 | EGFR (0.59) | EGFRITKBTKJAK2LYN | |
| SCHEMBL19624639 | 0.81 | EGFR (0.46) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL19544867 | 0.76 | SYK (0.48) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL17242399 | 0.76 | EGFR (0.64) | EGFRITKSYKBTKJAK2 | |
| SCHEMBL22663694 | 0.76 | NPC1 (0.63) | EGFRITKSYKBTKJAK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015170266-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS BTK INHIBITORS | LUPIN LIMITED (IN) | 2015-11-12 | — | — | WO | disclosed |
| WO-2015170266-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS BTK INHIBITORS | LUPIN LIMITED (IN) | 2015-11-12 | — | — | WO | disclosed |