Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29976895 | 0.88 | HPGD (0.37) | KIF11HPGDLMNAHCAR1CCNB2 | |
| SCHEMBL29976315 | 0.81 | KIF11 (0.36) | KIF11HPGDXDHSLC22A12ATM | |
| SCHEMBL29976260 | 0.81 | AR (0.41) | KIF11HPGDXDHSLC22A12ATM | |
| SCHEMBL29976910 | 0.81 | TTR (0.39) | KIF11HPGDXDHSLC22A12MAPT | |
| SCHEMBL29724426 | 0.80 | MAOB (0.51) | AR | |
| SCHEMBL29976613 | 0.79 | EPHX2 (0.49) | HPGDLMNAMCL1MAPTHSD17B10 | |
| SCHEMBL10519092 | 0.79 | HPGD (0.54) | KIF11HPGDLMNAATMMAPT | |
| SCHEMBL29976410 | 0.79 | HPGD (0.54) | KIF11HPGDLMNAATMMAPT | |
| SCHEMBL29977058 | 0.78 | KDM4E (0.42) | HPGDXDHSLC22A12KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL29977243 | 0.77 | LOXL2 (0.35) | KIF11HPGDXDHSLC22A12ATM |
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-115403558-A | Aromatic heterocyclic compound with antitumor activity and preparation method and application thereof | 河南真实生物科技有限公司 | 2022-11-29 | — | — | CN | disclosed |