Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | LTK | P29376 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27747567 | 0.87 | AXL (0.41) | EGFRAXLMKNK1MKNK2KDM4E | |
| SCHEMBL32388 | 0.87 | — | — | |
| SCHEMBL30711136 | 0.85 | AXL (0.39) | EGFRAXLMKNK1MKNK2KDM4E | |
| Hydrochloric Acid SCHEMBL21803551 | 0.85 | AXL (0.39) | EGFRAXLMKNK1MKNK2KDM4E | |
| SCHEMBL29362763 | 0.85 | — | — | |
| SCHEMBL83904 | 0.85 | — | — | |
| Hydrazine SCHEMBL5897595 | 0.83 | AXL (0.38) | EGFRCHEK1AURKADAPK3JAK2 | |
| SCHEMBL30155277 | 0.83 | CHEK1 (0.41) | EGFRCHEK1AURKADAPK3JAK2 | |
| Bromide SCHEMBL10378261 | 0.83 | CHEK1 (0.41) | EGFRCHEK1AURKADAPK3JAK2 | |
| Formaldehyde SCHEMBL28037402 | 0.82 | AXL (0.37) | EGFRNTRK1CLK4AXLMKNK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101675053-B | Phosphoinositide 3-kinase inhibitor compounds and methods of use | GENENTECH INC | 2014-03-12 | — | — | CN | disclosed |
| CN-101479274-B | Pharmaceutical compounds | HOFFMANN LA ROCHE | 2013-06-12 | — | — | CN | disclosed |
| CN-101479277-A | Pyrimidine derivatives as PI3K inhibitors | PIRAMED LTD (CH) | 2009-07-08 | — | — | CN | disclosed |