Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 4/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL6957360 | 0.94 | ENPP2 (0.33) | TLR7AGTR1AGTR2ENPP2 | |
| SCHEMBL7079248 | 0.90 | TDP1 (0.37) | ALDH1A1TDP1TLR7AGTR1AGTR2 | |
| SCHEMBL7087537 | 0.90 | TBXA2R (0.31) | ALDH1A1 | |
| SCHEMBL7084840 | 0.90 | TLR7 (0.38) | ALDH1A1TDP1TLR7 | |
| SCHEMBL6969774 | 0.89 | ENPP2 (0.35) | ALDH1A1TDP1TLR7AGTR1AGTR2 | |
| SCHEMBL6974486 | 0.89 | TLR8 (0.35) | ALDH1A1TDP1TLR7 | |
| SCHEMBL6961399 | 0.86 | PPARG (0.35) | TLR7AGTR1AGTR2ENPP2PPARG | |
| SCHEMBL6965833 | 0.85 | ALDH1A1 (0.32) | ALDH1A1TDP1 | |
| SCHEMBL6975444 | 0.84 | — | — | |
| SCHEMBL6966865 | 0.84 | P2RX3 (0.33) | ALDH1A1TDP1AGTR1AGTR2PPARG |
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 |