Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CDC25B | P30305 | 2/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL828480 | 0.90 | GABRA1 (0.48) | HSD17B10GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL4737757 | 0.88 | CDC25B (0.61) | HSD17B10CDC25BCDC25ASLC7A5ALDH1A1 | |
| SCHEMBL4737756 | 0.87 | CDC25B (0.55) | HSD17B10CDC25BCDC25AALDH1A1LMNA | |
| SCHEMBL2280244 | 0.85 | ELANE (0.47) | HSD17B10CDC25BCDC25AGABRA1GABRG2 | |
| SCHEMBL29439795 | 0.84 | ELANE (0.47) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL30111657 | 0.81 | TSHR (0.50) | HSD17B10CA1CA2CA9ALDH1A1 | |
| SCHEMBL109178 | 0.81 | TSHR (0.50) | HSD17B10CA1CA2CA9ALDH1A1 | |
| SCHEMBL2874165 | 0.81 | KDM4E (0.56) | HSD17B10CA12CA1CA2CA9 | |
| SCHEMBL10418402 | 0.80 | AKR1C3 (0.55) | HSD17B10CDC25BALDH1A1LMNAELANE | |
| SCHEMBL829131 | 0.80 | KDM4E (0.43) | GABRA1GABRG2GABRB3GABRA3GABRA2 |
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-2008060844-A1 | POLYMERIZATION INHIBITOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE | ALBEMARLE CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |