Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.31 |
| ▸ | PLK4 | O00444 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL7084513 | 0.85 | LMNA (0.39) | MAOAMAOBNOTUMTYMSMAPT | |
| SCHEMBL6972918 | 0.85 | CA2 (0.35) | MAOAMAOBHAO1NOTUMTYMS | |
| SCHEMBL6973949 | 0.84 | MAPT (0.39) | MAOAMAOBMAPTHPGDHTT | |
| SCHEMBL7084591 | 0.81 | HSP90AA1 (0.42) | HPGDALDH1A1 | |
| SCHEMBL6965624 | 0.81 | NPSR1 (0.36) | MAOAMAOBHAO1NOTUMTYMS | |
| SCHEMBL7082707 | 0.80 | GRIN1 (0.38) | CA2CA4HPGDHTTTP53 | |
| SCHEMBL6961911 | 0.78 | MAOA (0.38) | MAOAMAOBHAO1NOTUMTYMS | |
| SCHEMBL7080119 | 0.78 | MAOA (0.38) | MAOAMAOBHAO1NOTUMTYMS | |
| SCHEMBL7086413 | 0.77 | DRD2 (0.32) | — | |
| SCHEMBL6973122 | 0.74 | MIF (0.36) | MAOAMAOBHAO1NOTUMCA2 |
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 |