Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.33 |
| ▸ | VCP | P55072 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL6960433 | 0.90 | TDP1 (0.34) | VCPTDP1KMT2A | |
| SCHEMBL6974459 | 0.88 | HRH1 (0.37) | — | |
| SCHEMBL6972304 | 0.87 | HSP90B1 (0.37) | HSP90B1TRAP1VCPTDP1KMT2A | |
| SCHEMBL14439831 | 0.86 | HDAC1 (0.40) | HSP90B1TRAP1VCPTDP1 | |
| SCHEMBL6968293 | 0.86 | HSP90B1 (0.35) | HSP90B1TRAP1TDP1KMT2A | |
| SCHEMBL8100819 | 0.85 | HSP90B1 (0.33) | HSP90B1TRAP1KMT2A | |
| SCHEMBL8109133 | 0.84 | VCP (0.35) | VCPTDP1 | |
| SCHEMBL6972409 | 0.84 | VCP (0.35) | VCPTDP1 | |
| SCHEMBL8349607 | 0.84 | TDP1 (0.32) | TDP1KMT2AMCL1 | |
| SCHEMBL14439828 | 0.84 | TDP1 (0.40) | VCPTDP1KMT2A |
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 |