Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 5/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.33 |
| ▸ | PTAFR | P25105 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969763 | 0.95 | GRIN1 (0.35) | GRIN1GRIN2BS1PR3PTAFRGRM2 | |
| SCHEMBL6974966 | 0.94 | GRIN1 (0.36) | GRIN1GRIN2BS1PR3GRM2IDO1 | |
| SCHEMBL7083459 | 0.93 | GRIN1 (0.35) | GRIN1GRIN2BS1PR3PTAFRGRM2 | |
| SCHEMBL7085115 | 0.91 | ENPP2 (0.33) | GRIN1GRIN2BLMNAALDH1A1MAPT | |
| SCHEMBL6973316 | 0.90 | ALDH1A1 (0.39) | GRIN1GRIN2BGRM2LMNAALDH1A1 | |
| SCHEMBL6974469 | 0.90 | TLR7 (0.36) | S1PR3PTGDR2LMNAALDH1A1KMT2A | |
| SCHEMBL6970826 | 0.89 | GRIN1 (0.35) | GRIN1GRIN2BS1PR3GRM2IDO1 | |
| SCHEMBL6973955 | 0.88 | ALDH1A1 (0.35) | S1PR3LMNAALDH1A1KMT2A | |
| SCHEMBL7084614 | 0.88 | FKBP1A (0.38) | LMNAALDH1A1MAPTKMT2A | |
| SCHEMBL6966178 | 0.87 | ADRA1D (0.36) | S1PR3ALDH1A1KMT2A |
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 |