Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969004 | 0.92 | CYP1A2 (0.33) | SLC6A2SLC6A4SLC6A3GRIN1GRIN2B | |
| SCHEMBL7083143 | 0.89 | GABRA1 (0.34) | GRIN1GRIN2BALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6966820 | 0.89 | GRIN1 (0.38) | GRIN1GRIN2BKDM4EKMT2ASLC6A9 | |
| SCHEMBL7079929 | 0.89 | GRM5 (0.38) | POLBGRM5GRIN1GRIN2BKDM4E | |
| SCHEMBL6962202 | 0.89 | GRM5 (0.38) | SLC6A2SLC6A4SLC6A3GRM5GRIN1 | |
| SCHEMBL6961462 | 0.87 | GRIN1 (0.37) | POLBGRM5GRIN1GRIN2BKDM4E | |
| SCHEMBL6967528 | 0.87 | GRM5 (0.36) | GRM5GRIN1GRIN2BKDM4EL3MBTL1 | |
| SCHEMBL7082472 | 0.87 | ALDH1A1 (0.37) | GRM5GRIN1GRIN2BKDM4EL3MBTL1 | |
| SCHEMBL6969433 | 0.86 | KMT2A (0.38) | GRM5GRIN1GRIN2BKDM4EL3MBTL1 | |
| SCHEMBL6963923 | 0.85 | POLB (0.44) | SLC6A2SLC6A4SLC6A3POLBGRM5 |
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 |