Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7079372 | 0.92 | IRAK4 (0.38) | IRAK4ALDH1A1KDM4EL3MBTL1SMN1; SMN2 | |
| SCHEMBL6962127 | 0.89 | HSP90AA1 (0.38) | IRAK4ALDH1A1KDM4EL3MBTL1SMN1; SMN2 | |
| SCHEMBL6972012 | 0.89 | RAB9A (0.41) | IRAK4ALDH1A1L3MBTL1SMN1; SMN2MAPT | |
| SCHEMBL6957987 | 0.88 | MAPT (0.42) | ALDH1A1MAPTCYP2C9CYP2C19CYP2D6 | |
| SCHEMBL6961422 | 0.87 | HSP90AA1 (0.39) | IRAK4ALDH1A1L3MBTL1SMN1; SMN2MAPT | |
| SCHEMBL7083140 | 0.87 | CYP2C9 (0.39) | IRAK4ALDH1A1SMN1; SMN2MAPTCYP2C9 | |
| SCHEMBL6961923 | 0.86 | CYP1A2 (0.44) | ALDH1A1KDM4EL3MBTL1MAPTCYP1A2 | |
| SCHEMBL7088075 | 0.86 | MAPT (0.37) | IRAK4ALDH1A1SMN1; SMN2MAPTCYP2C19 | |
| SCHEMBL7084631 | 0.85 | MAPT (0.42) | ALDH1A1KDM4ESMN1; SMN2MAPTPOLB | |
| SCHEMBL7080984 | 0.85 | LMNA (0.38) | IRAK4ALDH1A1L3MBTL1SMN1; SMN2MAPT |
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 |