Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRA | P18433 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.31 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL6967986 | 0.92 | SLC6A9 (0.34) | PTPRAMAPK14KDM4EFDPSALDH1A1 | |
| SCHEMBL7081552 | 0.89 | PTPRA (0.34) | PTPRAKDM4EFDPSALDH1A1CYP1A2 | |
| SCHEMBL6963979 | 0.88 | PTPRA (0.39) | PTPRAKDM4EFDPSALDH1A1CYP1A2 | |
| SCHEMBL6976955 | 0.88 | RHEB (0.34) | PTPRAKDM4EFDPSALDH1A1CYP1A2 | |
| SCHEMBL6962115 | 0.86 | ADRB2 (0.32) | MAPK14 | |
| SCHEMBL7079932 | 0.84 | GRM5 (0.38) | PTPRAKDM4EALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL6973806 | 0.84 | — | — | |
| SCHEMBL7081706 | 0.84 | — | — | |
| SCHEMBL6973462 | 0.84 | ALDH1A1 (0.32) | PTPRAALDH1A1CYP1A2 | |
| SCHEMBL6960986 | 0.83 | GSK3B (0.32) | CYP1A2CYP2C19 |
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 |