Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7085473 | 0.92 | MEN1 (0.35) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL7080662 | 0.92 | LMNA (0.36) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL6969746 | 0.91 | MEN1 (0.40) | CYP2C9CYP2C19CYP2D6RECQLKMT2A | |
| SCHEMBL6964051 | 0.89 | IRAK4 (0.35) | CYP2C9CYP2C19CYP2D6RECQLKMT2A | |
| SCHEMBL6969228 | 0.86 | CACNA1F (0.35) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL6964269 | 0.86 | HSP90AA1 (0.39) | NPC1RAB9ACYP2D6KMT2AMEN1 | |
| SCHEMBL8345499 | 0.86 | FFAR1 (0.39) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL8345494 | 0.86 | FFAR1 (0.39) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL6961860 | 0.85 | MEN1 (0.42) | NPC1RAB9ACYP2C9CYP2C19CYP2D6 | |
| SCHEMBL7086066 | 0.85 | KMT2A (0.36) | CYP2C9CYP2C19CYP2D6RECQLKMT2A |
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 3 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 |