Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | FABP3 | P05413 | 1/20 | 0.31 |
| ▸ | FABP4 | P15090 | 1/20 | 0.31 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.31 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.30 |
| ▸ | KMO | O15229 | 2/20 | 0.30 |
| ▸ | USP7 | Q93009 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 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 | |
|---|---|---|---|---|
| SCHEMBL6969831 | 0.89 | SIRT1 (0.32) | CCR2CCR5HSP90B1HSP90AA1HSP90AB1 | |
| SCHEMBL8345609 | 0.88 | HDAC6 (0.39) | — | |
| SCHEMBL8345413 | 0.87 | ALDH1A1 (0.35) | HSP90B1HSP90AA1HSP90AB1TRAP1 | |
| Oxalic Acid SCHEMBL6973522 | 0.86 | HSP90B1 (0.31) | CCR2CCR5FABP3FABP4FABP5 | |
| SCHEMBL6163272 | 0.85 | HSP90B1 (0.33) | HSP90B1HSP90AA1HSP90AB1TRAP1 | |
| SCHEMBL6962129 | 0.85 | HSP90B1 (0.32) | CCR2CCR5HSP90B1HSP90AA1HSP90AB1 | |
| SCHEMBL6965470 | 0.83 | SETDB1 (0.33) | HSP90B1USP7HSP90AA1HSP90AB1TRAP1 | |
| SCHEMBL6162374 | 0.83 | HSP90B1 (0.32) | HSP90B1HSP90AA1HSP90AB1TRAP1 | |
| SCHEMBL6963215 | 0.83 | HSP90B1 (0.32) | HSP90B1HSP90AA1HSP90AB1TRAP1 | |
| SCHEMBL6165079 | 0.83 | HSP90B1 (0.32) | HSP90B1HSP90AA1HSP90AB1TRAP1 |
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 |