Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | AHCY | P23526 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10711559 | 0.89 | KDM4E (0.57) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL9763808 | 0.85 | KDM4E (0.58) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL9763803 | 0.85 | KDM4E (0.58) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| 6-Deoxy Penciclovir SCHEMBL660970 | 0.84 | ALDH1A1 (0.66) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| 6-Deoxy Penciclovir SCHEMBL29797811 | 0.84 | ALDH1A1 (0.66) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL10848639 | 0.83 | KDM4E (0.61) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| 6-Deoxy Penciclovir SCHEMBL3324010 | 0.83 | ALDH1A1 (0.65) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL9876041 | 0.82 | KDM4E (0.55) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL6307469 | 0.82 | KDM4E (0.57) | KDM4EALDH1A1HPGDADRA1AHSD17B10 | |
| SCHEMBL19242423 | 0.82 | KDM4E (0.60) | KDM4EALDH1A1HPGDADRA1AHSD17B10 |
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-1995022330-A1 | ANTIVIRAL AGENTS | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 1995-08-24 | — | — | WO | disclosed |