Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.63 |
| ▸ | HPGD | P15428 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | CLK2 | P49760 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28582458 | 1.00 | KDM4E (0.63) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28578693 | 0.95 | KDM4E (0.67) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28578692 | 0.95 | KDM4E (0.67) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28574913 | 0.94 | KDM4E (0.63) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28568271 | 0.94 | KDM4E (0.63) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28568269 | 0.94 | KDM4E (0.63) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28574912 | 0.94 | KDM4E (0.63) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28571852 | 0.94 | KDM4E (0.62) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28571853 | 0.94 | KDM4E (0.62) | KDM4EHPGDALDH1A1LMNACYP2C19 | |
| SCHEMBL28574779 | 0.94 | KDM4E (0.62) | KDM4EHPGDALDH1A1LMNACYP2C19 |
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-112824401-B | Acrylic ketone derivative of N-acetyl gatifloxacin and preparation method and application thereof | 河南大学 | 2023-08-11 | — | — | CN | disclosed |
| CN-112824401-A | N-acetyl gatifloxacin propenone derivative and preparation method and application thereof | 河南大学 | 2021-05-21 | — | — | CN | disclosed |