Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.32 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL6967234 | 0.88 | TYMS (0.30) | TYMS | |
| SCHEMBL6961917 | 0.88 | HAO1 (0.38) | CA2CA4HAO1SLC6A9TYMS | |
| SCHEMBL7087098 | 0.86 | TP53 (0.39) | SLC6A9TYMS | |
| SCHEMBL6974320 | 0.86 | MAPK14 (0.34) | CA2CA4HAO1SLC6A9TYMS | |
| SCHEMBL6967049 | 0.85 | LMNA (0.37) | — | |
| SCHEMBL7086270 | 0.82 | CA2 (0.36) | CA2CA4HAO1SLC6A9TYMS | |
| SCHEMBL7084551 | 0.82 | SLC6A9 (0.33) | CA2CA4HAO1SLC6A9TYMS | |
| SCHEMBL7085331 | 0.81 | HSP90AA1 (0.39) | — | |
| SCHEMBL7079967 | 0.81 | GCGR (0.36) | CA2CA4HAO1SLC6A9TYMS | |
| SCHEMBL6971303 | 0.80 | HAO1 (0.33) | CA2CA4HAO1SLC6A9TYMS |
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 |