Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 9/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6973461 | 0.93 | S1PR3 (0.39) | S1PR3GRM5KMT2AMEN1CYP1A2 | |
| SCHEMBL7078550 | 0.93 | S1PR3 (0.37) | S1PR3GRIN1GRIN2BGRM5KMT2A | |
| SCHEMBL7078713 | 0.92 | S1PR3 (0.39) | S1PR3GRIN1GRIN2BGRM5KMT2A | |
| SCHEMBL6974113 | 0.92 | S1PR3 (0.38) | S1PR3GRIN1GRIN2BKMT2ASLC6A9 | |
| SCHEMBL7081110 | 0.91 | S1PR3 (0.39) | S1PR3GRIN1GRIN2BKMT2ASLC6A9 | |
| SCHEMBL7084491 | 0.90 | CYP1A2 (0.40) | KMT2AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7081153 | 0.90 | MAPT (0.39) | GRIN1GRIN2BGRM5KMT2AMEN1 | |
| SCHEMBL6974025 | 0.87 | S1PR3 (0.36) | S1PR3GRIN1GRIN2BKMT2AENPP2 | |
| SCHEMBL7084592 | 0.87 | CFTR (0.41) | S1PR3KMT2AMEN1CYP1A2 | |
| SCHEMBL6969000 | 0.87 | S1PR3 (0.36) | S1PR3GRIN1GRIN2BGRM5SLC6A9 |
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 |