Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4041721 | 0.88 | GAA (0.51) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4034808 | 0.88 | GAA (0.51) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4041974 | 0.88 | GAA (0.51) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4036566 | 0.87 | ALDH1A1 (0.62) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4037945 | 0.87 | ALDH1A1 (0.47) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4032653 | 0.87 | MAPK1 (0.51) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4040978 | 0.87 | ALDH1A1 (0.47) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4035266 | 0.87 | ALDH1A1 (0.47) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4033038 | 0.87 | ALDH1A1 (0.47) | ALDH1A1HTTLMNAGLAPKM | |
| SCHEMBL4034771 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HTTLMNAGLAPKM |
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-1592389-B1 | PIPERAZINE-2-CARBOXAMIDE DERIVATIVES | SERONO LAB (CH) | 2009-04-22 | — | — | EP | claimed |