Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 3/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | ACR | P10323 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14565138 | 0.84 | SLC6A3 (0.56) | SLC6A3KMT2AHTTMAPTMGLL | |
| SCHEMBL4370822 | 0.82 | TSHR (0.47) | MAPTKDM4EALDH1A1 | |
| SCHEMBL235014 | 0.78 | SLC6A3 (0.55) | SLC6A3KMT2AHTTMAPTKDM4E | |
| SCHEMBL236650 | 0.77 | SLC6A3 (0.54) | SLC6A3KMT2AHTTMAPTKDM4E | |
| SCHEMBL13143633 | 0.74 | SLC6A3 (0.51) | SLC6A3KMT2AHTTMAPTKDM4E | |
| SCHEMBL23231157 | 0.73 | KMT2A (0.65) | SLC6A3KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL22981993 | 0.72 | KMT2A (0.56) | SLC6A3KMT2AHTTMAPTALDH1A1 | |
| SCHEMBL19975481 | 0.71 | CA12 (0.52) | HTTMAPTKDM4EHSP90AA1NPSR1 | |
| SCHEMBL26622111 | 0.70 | KMT2A (0.47) | SLC6A3KMT2AHTTMAPTKDM4E | |
| SCHEMBL22990373 | 0.70 | SLC6A3 (0.63) | SLC6A3KMT2AHTTMAPTKDM4E |
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-2009033079-A1 | EXTERNALLY MASKED NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE | XENOPORT, INC. (US) | 2009-03-12 | — | — | WO | disclosed |