Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 14/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 8/20 | 0.49 |
| ▸ | KDR | P35968 | 10/20 | 0.48 |
| ▸ | EPHB4 | P54760 | 7/20 | 0.47 |
| ▸ | EPHA2 | P29317 | 6/20 | 0.47 |
| ▸ | FLT1 | P17948 | 5/20 | 0.47 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.47 |
| ▸ | RET | P07949 | 2/20 | 0.47 |
| ▸ | EPHB2 | P29323 | 2/20 | 0.47 |
| ▸ | EPHA4 | P54764 | 2/20 | 0.47 |
| ▸ | BTK | Q06187 | 2/20 | 0.47 |
| ▸ | RIPK3 | Q9Y572 | 2/20 | 0.47 |
| ▸ | GAK | O14976 | 1/20 | 0.47 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.47 |
| ▸ | STK10 | O94804 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | YES1 | P07947 | 1/20 | 0.47 |
| ▸ | LYN | P07948 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17967489 | 0.91 | EGFR (0.57) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL20653156 | 0.89 | EGFR (0.57) | EGFRERBB2KDR | |
| SCHEMBL18012884 | 0.88 | EGFR (0.53) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL19100062 | 0.88 | EGFR (0.53) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL18012086 | 0.87 | EGFR (0.63) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL18012085 | 0.87 | EGFR (0.63) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL19100075 | 0.86 | EGFR (0.66) | EGFRKDR | |
| SCHEMBL19100462 | 0.84 | EGFR (0.52) | EGFRERBB2KDREPHB4EPHA2 | |
| SCHEMBL19100267 | 0.84 | EGFR (0.61) | EGFRERBB2KDR | |
| SCHEMBL17967491 | 0.84 | KDR (0.61) | EGFRERBB2KDREPHB4EPHA2 |
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-2017117680-A1 | NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS | TRILLIUM THERAPEUTICS INC. (CA) | 2017-07-13 | — | — | WO | disclosed |