Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.48 |
| ▸ | ULK1 | O75385 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 6/20 | 0.45 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.44 |
| ▸ | ZAP70 | P43403 | 3/20 | 0.44 |
| ▸ | IGF1R | P08069 | 2/20 | 0.44 |
| ▸ | PLK1 | P53350 | 2/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | PLK4 | O00444 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | PAK4 | O96013 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29083976 | 0.90 | LRRK2 (0.46) | LRRK2ULK1EGFRALKIGF1R | |
| SCHEMBL29084066 | 0.89 | EGFR (0.55) | MAP4K1LRRK2EGFRALKIGF1R | |
| SCHEMBL29084072 | 0.81 | EGFR (0.54) | LRRK2EGFRALKIGF1RPLK1 | |
| SCHEMBL29084007 | 0.81 | EGFR (0.51) | LRRK2EGFRALKIGF1RPLK1 | |
| SCHEMBL29083952 | 0.81 | PLK1 (0.52) | EGFRPLK1CHEK1AURKAJAK2 | |
| SCHEMBL29084155 | 0.81 | EGFR (0.56) | EGFRALKIGF1RPLK1 | |
| SCHEMBL29084120 | 0.81 | EGFR (0.64) | MAP4K1EGFRALKIGF1RCHEK1 | |
| SCHEMBL29084107 | 0.80 | EGFR (0.46) | MAP4K1LRRK2EGFRALKCSF1R | |
| SCHEMBL29083968 | 0.80 | ALK (0.44) | MAP4K1LRRK2EGFRALKIGF1R | |
| SCHEMBL29084049 | 0.79 | ULK1 (0.48) | LRRK2ULK1EGFRALKZAP70 |
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-116670127-A | EGFR inhibitors and compositions and uses thereof | 贝达药业股份有限公司 | 2023-08-29 | — | — | CN | claimed |
| CN-116670127-A | EGFR inhibitors and compositions and uses thereof | 贝达药业股份有限公司 | 2023-08-29 | — | — | CN | disclosed |
| WO-2022206797-A1 | EGFR INHIBITOR, AND COMPOSITION AND USE THEREOF | 贝达药业股份有限公司 | 2022-10-06 | — | — | WO | disclosed |