Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | MAPT | P10636 | 3/20 | 0.73 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.54 |
| ▸ | CDC7 | O00311 | 4/20 | 0.54 |
| ▸ | DBF4 | Q9UBU7 | 4/20 | 0.54 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | JAK2 | O60674 | 1/20 | 0.49 |
| ▸ | JAK3 | P52333 | 1/20 | 0.49 |
| ▸ | RARA | P10276 | 1/20 | 0.48 |
| ▸ | RARB | P10826 | 1/20 | 0.48 |
| ▸ | RARG | P13631 | 1/20 | 0.48 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27519692 | 0.92 | KDM4E (0.67) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL4268936 | 0.87 | KDM4E (0.77) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL4738310 | 0.83 | ALDH1A1 (0.71) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL5556366 | 0.83 | TBK1 (0.55) | KDM4EALDH1A1MAPTGAAIKBKB | |
| SCHEMBL11652002 | 0.82 | MAPT (0.69) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL14148528 | 0.81 | KDM4E (0.68) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL4737628 | 0.79 | KDM4E (0.64) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL14148405 | 0.77 | ALDH1A1 (0.67) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL4737640 | 0.77 | KDM4E (0.63) | KDM4EALDH1A1MAPTPOLBGAA | |
| SCHEMBL14148414 | 0.77 | ALDH1A1 (0.63) | KDM4EALDH1A1MAPTNTRK1SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008090382-A1 | THIAZOLE AND OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF PRION DISEASES, CANCER AND CONDITIONS OF THE CENTRAL NERVOUS SYSTEM AS WELL AS IN THE REGULATION OF STEM CELLS | THE UNIVERSITY OF SHEFFIELD (GB) | 2008-07-31 | — | — | WO | disclosed |