Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 4/20 | 0.32 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 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 | |
|---|---|---|---|---|
| SCHEMBL6974486 | 0.94 | TLR8 (0.35) | HSP90B1TRAP1ALDH1A1TDP1TLR7 | |
| SCHEMBL6971451 | 0.92 | HSP90B1 (0.33) | HSP90B1TRAP1CCR2CCR5KDM4E | |
| SCHEMBL6969515 | 0.90 | TLR7 (0.35) | HSP90B1TRAP1CCR2CCR5KDM4E | |
| SCHEMBL6957360 | 0.89 | ENPP2 (0.33) | TLR7 | |
| SCHEMBL6969945 | 0.88 | KCNH2 (0.34) | HSP90B1TRAP1TDP1TLR8 | |
| SCHEMBL6966285 | 0.86 | P2RX3 (0.33) | HSP90B1TRAP1KDM4EALDH1A1HPGD | |
| Carbamic Acid SCHEMBL5064953 | 0.85 | PIM1 (0.35) | P2RX3TDP1 | |
| SCHEMBL6969108 | 0.85 | TSHR (0.38) | KDM4ESMN1; SMN2P2RX3 | |
| SCHEMBL6969846 | 0.85 | KDM4E (0.33) | HSP90B1TRAP1KDM4EALDH1A1HPGD | |
| SCHEMBL7087497 | 0.84 | P2RX3 (0.36) | CCR2CCR5ALDH1A1P2RX3TDP1 |
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 |