Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MDM4 | O15151 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Methylamine SCHEMBL28040371 | 0.82 | — | — | |
| SCHEMBL28040871 | 0.78 | HDAC4 (0.35) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| SCHEMBL28040373 | 0.77 | HDAC4 (0.34) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| SCHEMBL25470348 | 0.76 | HDAC4 (0.41) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| SCHEMBL7626453 | 0.75 | HDAC4 (0.44) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| SCHEMBL28040424 | 0.73 | HDAC4 (0.32) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| Methylamine SCHEMBL27942526 | 0.73 | ESR1 (0.32) | — | |
| Methylamine SCHEMBL28040876 | 0.72 | PNMT (0.40) | ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL28823587 | 0.72 | HDAC4 (0.33) | HDAC4HDAC8ALDH1A1ALOX12HTT | |
| SCHEMBL28040388 | 0.72 | HDAC4 (0.33) | HDAC4HDAC8ALDH1A1ALOX12HTT |
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-102666561-B | Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2015-11-25 | — | — | CN | disclosed |