Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 15/20 | 0.70 |
| ▸ | INSR | P06213 | 5/20 | 0.68 |
| ▸ | IGF1R | P08069 | 5/20 | 0.68 |
| ▸ | ALK | Q9UM73 | 5/20 | 0.68 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.56 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.56 |
| ▸ | JAK2 | O60674 | 1/20 | 0.56 |
| ▸ | RET | P07949 | 1/20 | 0.56 |
| ▸ | MET | P08581 | 1/20 | 0.56 |
| ▸ | ROS1 | P08922 | 1/20 | 0.56 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.56 |
| ▸ | KIT | P10721 | 1/20 | 0.56 |
| ▸ | PIM1 | P11309 | 1/20 | 0.56 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.56 |
| ▸ | FER | P16591 | 1/20 | 0.56 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.56 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.56 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.56 |
| ▸ | AXL | P30530 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL29084127 | 0.93 | EGFR (0.68) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29084060 | 0.93 | EGFR (0.68) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29084078 | 0.91 | EGFR (0.65) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29084027 | 0.91 | EGFR (0.65) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29083994 | 0.91 | EGFR (0.65) | EGFRINSRIGF1RALK | |
| SCHEMBL29084180 | 0.90 | ALK (0.67) | EGFRINSRIGF1RALK | |
| SCHEMBL29084120 | 0.90 | EGFR (0.64) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29084046 | 0.90 | EGFR (0.64) | EGFRINSRIGF1RALKCHEK1 | |
| SCHEMBL29083967 | 0.90 | EGFR (0.66) | EGFRINSRIGF1RALK | |
| SCHEMBL29083944 | 0.90 | INSR (0.67) | EGFRINSRIGF1RALKCHEK1 |
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 4 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 |
| WO-2022206797-A1 | EGFR INHIBITOR, AND COMPOSITION AND USE THEREOF | 贝达药业股份有限公司 | 2022-10-06 | — | — | WO | 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 |