Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ANO1 | Q5XXA6 | 8/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11049975 | 0.84 | HTT (0.48) | HTTALDH1A1KDM4EPOLBCACNA1H | |
| SCHEMBL11056677 | 0.84 | HTT (0.46) | HTTALDH1A1KDM4EANO1POLB | |
| SCHEMBL11048657 | 0.83 | HTT (0.47) | HTTALDH1A1KDM4EPOLBCACNA1H | |
| SCHEMBL11257844 | 0.83 | CACNA1C (0.47) | HTTALDH1A1KDM4EANO1POLB | |
| SCHEMBL11054286 | 0.82 | HTT (0.43) | HTTALDH1A1KDM4EANO1POLB | |
| SCHEMBL11053847 | 0.80 | HTT (0.49) | HTTALDH1A1POLBCACNA1HCYP2D6 | |
| SCHEMBL11256873 | 0.80 | SCN5A (0.36) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL11052568 | 0.80 | HTT (0.47) | HTTALDH1A1KDM4EPOLBMAPK1 | |
| SCHEMBL11051610 | 0.80 | HTT (0.53) | HTTALDH1A1KDM4EANO1POLB | |
| SCHEMBL11246227 | 0.79 | MAPK1 (0.41) | HTTALDH1A1KDM4EANO1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |