Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 7/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6974277 | 0.94 | GRIN1 (0.34) | GRIN1GRIN2BS1PR3ENPP2TLR7 | |
| SCHEMBL6967842 | 0.91 | ENPP2 (0.33) | GRIN1GRIN2BENPP2LMNA | |
| SCHEMBL7086281 | 0.90 | ENPP2 (0.38) | GRIN1GRIN2BS1PR3ENPP2LMNA | |
| SCHEMBL7085898 | 0.90 | ALDH1A1 (0.37) | GRIN1GRIN2BGAAKMT2AS1PR3 | |
| SCHEMBL6976430 | 0.90 | HTT (0.34) | GAAS1PR3TLR7HTTSMN1; SMN2 | |
| SCHEMBL6972338 | 0.88 | GRIN1 (0.38) | GRIN1GRIN2BKMT2AS1PR3ENPP2 | |
| SCHEMBL6962639 | 0.88 | RXFP1 (0.37) | GAALMNAHTTSMN1; SMN2KDM4E | |
| SCHEMBL7080182 | 0.87 | MAPT (0.35) | GRIN1GRIN2BKMT2AS1PR3HTT | |
| SCHEMBL6969443 | 0.85 | DHODH (0.32) | — | |
| SCHEMBL6961326 | 0.85 | GRIN1 (0.39) | GRIN1GRIN2BGAAKMT2AS1PR3 |
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 3 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 |
| EP-0786455-A1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1997-07-30 | — | — | EP | disclosed |