Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27896612 | 0.81 | ALDH1A1 (0.56) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL27996928 | 0.80 | KDM4E (0.54) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL610655 | 0.78 | KDM4E (0.51) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL9621352 | 0.76 | KDM4E (0.54) | KDM4EALDH1A1HPGDACHECA1 | |
| Hydrochloric Acid SCHEMBL11085862 | 0.75 | KDM4E (0.53) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL7874783 | 0.74 | KDM4E (0.51) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL27913992 | 0.74 | KDM4E (0.48) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL11979366 | 0.73 | ALDH1A1 (0.50) | KDM4EALDH1A1HPGDACHECA1 | |
| SCHEMBL11083951 | 0.72 | ALDH1A1 (0.49) | KDM4EALDH1A1HPGDACHE | |
| SCHEMBL9380807 | 0.72 | PTGS2 (0.54) | KDM4EALDH1A1HPGDACHEPTGS2 |
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-102993157-B | Alpha-naphthoflavone derivative, preparation method and application thereof | UNIV SHANGHAI JIAOTONG | 2015-04-01 | — | — | CN | disclosed |