Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | CDC7 | O00311 | 1/20 | 0.32 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 5/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL285901 | 0.87 | POLB (0.42) | TSHRALDH1A1HSD17B10L3MBTL1KDM4E | |
| SCHEMBL285902 | 0.87 | POLB (0.42) | TSHRALDH1A1HSD17B10L3MBTL1KDM4E | |
| SCHEMBL285868 | 0.87 | IKBKB (0.35) | LMNA | |
| SCHEMBL285869 | 0.87 | IKBKB (0.35) | LMNA | |
| SCHEMBL285997 | 0.85 | KMT2A (0.36) | TSHRPOLBKMT2A | |
| SCHEMBL2749746 | 0.83 | ALDH1A1 (0.38) | TSHRALDH1A1L3MBTL1KDM4EHPGD | |
| SCHEMBL286202 | 0.83 | ALDH1A1 (0.38) | TSHRALDH1A1L3MBTL1KDM4EHPGD | |
| SCHEMBL286203 | 0.83 | ALDH1A1 (0.38) | TSHRALDH1A1L3MBTL1KDM4EHPGD | |
| SCHEMBL286047 | 0.82 | CDC7 (0.34) | ALDH1A1L3MBTL1KDM4ECDC7DBF4 | |
| SCHEMBL285632 | 0.81 | ALDH1A1 (0.35) | ALDH1A1HSD17B10L3MBTL1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2427459-A1 | ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS | F. Hoffmann-La Roche AG (CH) | 2012-03-14 | — | — | EP | disclosed |