Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 5/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL8256872 | 0.69 | HDAC1 (0.51) | CYP3A4APPCYP2C9HDAC1HDAC8 | |
| SCHEMBL11108631 | 0.66 | AKR1B10 (0.50) | TTRKDM4EALDH1A1AKR1B10AKR1B1 | |
| SCHEMBL11108630 | 0.66 | AKR1B10 (0.50) | TTRKDM4EALDH1A1AKR1B10AKR1B1 | |
| SCHEMBL2771939 | 0.65 | CA12 (0.65) | TTRAKR1B10AKR1B1CYP3A4ALOX5 | |
| SCHEMBL21232190 | 0.65 | HDAC4 (0.66) | KMT2AMEN1PTGS2MAPT | |
| SCHEMBL29355747 | 0.65 | HDAC4 (0.66) | KMT2AMEN1PTGS2MAPT | |
| Ethyl Cinnamate SCHEMBL112446 | 0.64 | CA12 (0.72) | TTRALDH1A1AKR1B10AKR1B1KMT2A | |
| Ethyl Cinnamate SCHEMBL112445 | 0.64 | CA12 (0.72) | TTRALDH1A1AKR1B10AKR1B1KMT2A | |
| Ethyl Cinnamate SCHEMBL12001792 | 0.64 | CA12 (0.72) | TTRALDH1A1AKR1B10AKR1B1KMT2A | |
| Ethyl Cinnamate SCHEMBL1866942 | 0.64 | CA12 (0.72) | TTRALDH1A1AKR1B10AKR1B1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006101456-A1 | BICYCLIC HETEROCYCLES HYDROXAMATE COMPOUNDS USEFUL AS HISTONE DEACETYLASE (HDAC) INHIBITORS | S*BIO PTE LTD (SG) | 2006-09-28 | — | — | WO | disclosed |