Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.30 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.30 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969765 | 0.95 | SMN1; SMN2 (0.31) | TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6965901 | 0.92 | RAB9A (0.35) | TDP1NPC1RAB9ASMN1; SMN2ENPP2 | |
| SCHEMBL6968851 | 0.90 | NPC1 (0.31) | NPC1RAB9ASMN1; SMN2ENPP2 | |
| SCHEMBL6964951 | 0.87 | ALDH1A1 (0.32) | SMN1; SMN2 | |
| SCHEMBL7084635 | 0.87 | ADRA1D (0.35) | SMN1; SMN2HSP90B1 | |
| SCHEMBL8523903 | 0.86 | GRM4 (0.31) | TDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6970972 | 0.86 | HRH1 (0.31) | HSP90B1TRAP1 | |
| SCHEMBL6972231 | 0.85 | NPC1 (0.30) | NPC1RAB9ASMN1; SMN2ENPP2 | |
| SCHEMBL7081079 | 0.85 | HSP90B1 (0.33) | SMN1; SMN2HSP90B1TRAP1 | |
| SCHEMBL6973396 | 0.85 | PIM1 (0.34) | TDP1ENPP2HSP90B1TRAP1 |
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 |