Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 9/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 4/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 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 | |
|---|---|---|---|---|
| SCHEMBL6961563 | 0.94 | S1PR3 (0.37) | S1PR3GRM5PLA2G2A | |
| SCHEMBL7078550 | 0.93 | S1PR3 (0.37) | S1PR3GRIN1GRIN2BGRM5SLC6A9 | |
| SCHEMBL7078426 | 0.93 | S1PR3 (0.38) | S1PR3GRIN1GRIN2BSLC6A9PLA2G2A | |
| SCHEMBL7078713 | 0.93 | S1PR3 (0.39) | S1PR3GRIN1GRIN2BNPC1RAB9A | |
| SCHEMBL7087646 | 0.91 | S1PR3 (0.37) | S1PR3GRIN1GRIN2BSLC6A9PLA2G2A | |
| SCHEMBL6967466 | 0.91 | ALDH1A1 (0.33) | NPC1RAB9APLA2G2A | |
| SCHEMBL6970942 | 0.91 | MAPT (0.35) | GRIN1GRIN2BNPC1RAB9AGRM5 | |
| SCHEMBL6974365 | 0.89 | GRIN1 (0.35) | S1PR3GRIN1GRIN2BSLC6A9ADORA2A | |
| SCHEMBL7080059 | 0.89 | CFTR (0.38) | S1PR3NPC1RAB9A | |
| SCHEMBL7081480 | 0.87 | ADRA1D (0.34) | S1PR3NPC1RAB9AGRM5PLA2G2A |
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 |