Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL6973954 | 0.92 | ROCK1 (0.32) | MAPK14 | |
| SCHEMBL6973133 | 0.89 | CYP19A1 (0.31) | CYP19A1 | |
| SCHEMBL7079754 | 0.89 | IDO1 (0.37) | — | |
| SCHEMBL7080940 | 0.89 | MEN1 (0.31) | GSK3BCYP19A1 | |
| SCHEMBL6975056 | 0.87 | ALDH1A1 (0.36) | CYP19A1 | |
| SCHEMBL7079384 | 0.86 | — | — | |
| SCHEMBL7079175 | 0.86 | — | — | |
| SCHEMBL6973462 | 0.85 | ALDH1A1 (0.32) | — | |
| SCHEMBL6960986 | 0.85 | GSK3B (0.32) | GSK3B | |
| SCHEMBL6972752 | 0.85 | CDC7 (0.32) | GSK3BMAPK14CYP19A1 |
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 4 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 |
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |