Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL286096 | 0.86 | KMT2A (0.39) | ALDH1A1L3MBTL1GAAKMT2ASMN1; SMN2 | |
| SCHEMBL2749182 | 0.85 | GAA (0.40) | ALDH1A1L3MBTL1GAASMN1; SMN2LMNA | |
| SCHEMBL285759 | 0.82 | GABRA5 (0.41) | L3MBTL1GABRA5 | |
| SCHEMBL285760 | 0.80 | SLC8A1 (0.41) | L3MBTL1POLBGABRA5 | |
| SCHEMBL286095 | 0.79 | GABRA5 (0.43) | L3MBTL1GABRA5 | |
| SCHEMBL286071 | 0.79 | GABRA5 (0.41) | L3MBTL1GABRA5 | |
| SCHEMBL286047 | 0.79 | CDC7 (0.34) | ALDH1A1L3MBTL1CDC7DBF4SMN1; SMN2 | |
| SCHEMBL286248 | 0.79 | GABRA5 (0.51) | GABRA5 | |
| SCHEMBL286463 | 0.77 | ALDH1A1 (0.34) | ALDH1A1L3MBTL1GAAMEN1KMT2A | |
| SCHEMBL286143 | 0.76 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1GAAMEN1KMT2A |
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 |