Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | KLK7 | P49862 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16670594 | 0.80 | HDAC4 (0.62) | HDAC1HDAC4ALDH1A1HDAC3HDAC6 | |
| SCHEMBL5592720 | 0.79 | HDAC1 (0.47) | HDAC1HDAC4ALDH1A1KLK7TSHR | |
| SCHEMBL14106943 | 0.77 | ALDH1A1 (0.62) | HDAC1HDAC4ALDH1A1HDAC6HPGD | |
| SCHEMBL11426592 | 0.76 | KDM4E (0.53) | ALDH1A1TDP1SMN1; SMN2 | |
| SCHEMBL5452549 | 0.73 | HDAC3 (0.56) | ALDH1A1HDAC3HDAC6NCOR2HSD17B10 | |
| SCHEMBL12319261 | 0.73 | ALDH1A1 (0.55) | HDAC1HDAC4ALDH1A1HDAC3HDAC6 | |
| SCHEMBL13485760 | 0.72 | ALDH1A1 (0.59) | HDAC1ALDH1A1HDAC6CA1HSD17B10 | |
| SCHEMBL10933569 | 0.70 | ALDH1A1 (0.38) | HDAC1HDAC4ALDH1A1HSD17B10KLK7 | |
| SCHEMBL7108252 | 0.70 | — | — | |
| SCHEMBL25060910 | 0.69 | — | — |
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-114956963-A | Method for preparing 2, 6-di-tert-butyl-p-cresol from furan 2, 5-diformylaldehyde dioxime | 河北工业大学 | 2022-08-30 | — | — | CN | disclosed |