Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 3/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.46 |
| ▸ | IL2 | P60568 | 1/20 | 0.46 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.43 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 2/20 | 0.39 |
| ▸ | KDM4B | O94953 | 2/20 | 0.39 |
| ▸ | KDM5C | P41229 | 2/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | TNKS | O95271 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.38 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.37 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.37 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL31529591 | 0.99 | ACVR1 (0.45) | ACVR1TGFBR1KCNH2MAP4K1IL2 | |
| SCHEMBL29440634 | 0.77 | IP6K1 (0.60) | ACVR1MAP4K1IL2BRD9IP6K1 | |
| Hydrochloric Acid SCHEMBL31529629 | 0.76 | IP6K1 (0.58) | ACVR1MAP4K1IL2BRD9IP6K1 | |
| SCHEMBL29874700 | 0.74 | EGFR (0.47) | MAP4K1BRD9IP6K1KDM4AKDM4B | |
| SCHEMBL3279714 | 0.74 | SRC (0.49) | ACVR1TGFBR1MAP4K1IL2EGFR | |
| SCHEMBL29440622 | 0.74 | PARP1 (0.50) | ACVR1MAP4K1IL2BRD9IP6K1 | |
| SCHEMBL29440635 | 0.73 | MAP4K1 (0.47) | ACVR1MAP4K1IL2BRD9IP6K1 | |
| SCHEMBL1058891 | 0.69 | ZAP70 (0.62) | KCNH2MAP4K1IL2ZAP70SYK | |
| Trifluoroacetic Acid SCHEMBL29919880 | 0.67 | PARP1 (0.53) | MAP4K1BRD9IP6K1KDM4AKDM4B | |
| SCHEMBL21886642 | 0.67 | ERBB2 (0.46) | EGFRPARP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120004861-A | Allosteric EGFR inhibitors and methods of use thereof | 达纳-法伯癌症研究所股份有限公司 | 2025-05-16 | — | — | CN | disclosed |
| CN-115066240-A | Allosteric EGFR inhibitors and methods of use thereof | 达纳-法伯癌症研究所股份有限公司 | 2022-09-16 | — | — | CN | disclosed |