Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6966597 | 0.95 | FKBP1A (0.35) | ADRA1DMCL1GABRA1GABRA5CACNA1I | |
| SCHEMBL6973316 | 0.94 | ALDH1A1 (0.39) | ADRA1DMCL1GABRA1GABRA5ALDH1A1 | |
| SCHEMBL6973962 | 0.93 | ADRA1D (0.35) | ADRA1DMCL1GABRA1GABRA5CACNA1I | |
| SCHEMBL6957033 | 0.92 | ADRA1D (0.37) | ADRA1DGABRA1GABRA5CACNA1IS1PR3 | |
| SCHEMBL6973955 | 0.91 | ALDH1A1 (0.35) | GABRA1GABRA5S1PR3ALDH1A1MEN1 | |
| SCHEMBL6973396 | 0.91 | PIM1 (0.34) | HSP90B1MEN1KMT2AP2RX3 | |
| SCHEMBL6974966 | 0.90 | GRIN1 (0.36) | S1PR3 | |
| SCHEMBL6974469 | 0.90 | TLR7 (0.36) | GABRA1GABRA5S1PR3ALDH1A1KMT2A | |
| SCHEMBL6973497 | 0.89 | ALDH1A1 (0.38) | ADRA1DMCL1GABRA1GABRA5ALDH1A1 | |
| SCHEMBL6973223 | 0.87 | TDP1 (0.33) | ALDH1A1MEN1KMT2AP2RX3 |
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 |