Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20117027 | 0.79 | PDE4A (0.42) | KDM4EALDH1A1HPGDCHEK1GAA | |
| SCHEMBL21749932 | 0.79 | PDE4A (0.43) | KDM4EALDH1A1HPGDCHEK1GAA | |
| SCHEMBL20676395 | 0.77 | CHEK1 (0.40) | KDM4EALDH1A1HPGDHSD17B10CHEK1 | |
| SCHEMBL21097993 | 0.76 | KDM4E (0.38) | KDM4EALDH1A1HPGDHSD17B10CHEK1 | |
| SCHEMBL20116484 | 0.74 | CHEK1 (0.44) | KDM4EALDH1A1HSD17B10CHEK1GAA | |
| SCHEMBL21045855 | 0.72 | CHEK1 (0.40) | KDM4EALDH1A1HSD17B10CHEK1PDE4A | |
| SCHEMBL30439920 | 0.72 | CHEK1 (0.40) | KDM4EALDH1A1HSD17B10CHEK1PDE4A | |
| SCHEMBL21045740 | 0.69 | LTA4H (0.47) | HPGDCHEK1GAACTSSCSF1R | |
| SCHEMBL30439893 | 0.69 | LTA4H (0.47) | HPGDCHEK1GAACTSSCSF1R | |
| SCHEMBL21045796 | 0.68 | AR (0.44) | KDM4ECHEK1CTSSCYP1A2 |
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-117777121-A | Compounds and uses thereof | 詹森药业有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-110099898-B | Compounds and uses thereof | 优曼尼蒂治疗公司 | 2023-07-25 | — | — | CN | disclosed |