Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8349406 | 0.79 | USP2 (0.36) | KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL6966153 | 0.79 | CDK4 (0.30) | — | |
| SCHEMBL6971477 | 0.77 | HEXA (0.34) | — | |
| SCHEMBL8349410 | 0.71 | ACHE (0.33) | — | |
| SCHEMBL5971176 | 0.64 | ALDH1A1 (0.55) | KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL9686081 | 0.64 | ALDH1A1 (0.55) | KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL2111888 | 0.62 | ALDH1A1 (0.44) | KDM4EHSD17B10ALDH1A1ELANE | |
| Ethyl Acetate SCHEMBL17968659 | 0.62 | ALDH1A1 (0.70) | HSD17B10ALDH1A1 | |
| SCHEMBL4065146 | 0.61 | ALDH1A1 (0.39) | KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL14225501 | 0.60 | CYP1A2 (0.36) | KDM4EHSD17B10ALDH1A1ELANE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |