Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | PDE1A | P54750 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28236647 | 1.00 | EGFR (0.45) | EGFRPIK3CDPIK3CAMETPDE1A | |
| SCHEMBL2611054 | 0.79 | EGFR (0.55) | EGFRPIK3CDPIK3CAPDE10AFGFR4 | |
| SCHEMBL30804805 | 0.79 | EGFR (0.55) | EGFRPIK3CDPIK3CAFGFR4BRAF | |
| SCHEMBL23335615 | 0.76 | EGFR (0.51) | EGFRPIK3CDPIK3CAMETFGFR4 | |
| SCHEMBL27666530 | 0.76 | EGFR (0.51) | EGFRPIK3CDPIK3CAFGFR4TDO2 | |
| SCHEMBL2619213 | 0.75 | EGFR (0.50) | EGFRPIK3CDPIK3CAFGFR4BRAF | |
| SCHEMBL16105634 | 0.75 | CES2 (0.44) | CYP1A2PDPK1AKR1C3AKR1C2 | |
| SCHEMBL21648655 | 0.74 | EGFR (0.49) | EGFRPIK3CDPIK3CAFGFR4BRAF | |
| SCHEMBL20032418 | 0.72 | EGFR (0.50) | EGFRPIK3CDPIK3CAMETFGFR4 | |
| SCHEMBL28128185 | 0.72 | EGFR (0.46) | EGFRFGFR4USP2CYP1A2TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108473472-A | 2-aminoquinazoline derivatives as P70S6 kinase inhibitors | 圣提内尔肿瘤学有限公司 | 2018-08-31 | — | — | CN | disclosed |