Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.66 |
| ▸ | BRD4 | O60885 | 3/20 | 0.60 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.54 |
| ▸ | BRD2 | P25440 | 2/20 | 0.54 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.53 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.48 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5716989 | 1.00 | ALDH1A1 (0.66) | ALDH1A1HTTBRD4HSD11B1BRD2 | |
| SCHEMBL5716988 | 1.00 | ALDH1A1 (0.66) | ALDH1A1HTTBRD4HSD11B1BRD2 | |
| SCHEMBL2705744 | 0.96 | BRD4 (0.65) | ALDH1A1HTTBRD4BRD2HCRTR1 | |
| SCHEMBL2705750 | 0.96 | BRD4 (0.65) | ALDH1A1HTTBRD4BRD2HCRTR1 | |
| SCHEMBL5717368 | 0.88 | BRD4 (0.56) | ALDH1A1HTTBRD4HSD11B1BRD2 | |
| SCHEMBL23787095 | 0.87 | BRD4 (0.80) | ALDH1A1BRD4BRD2HCRTR1HCRTR2 | |
| SCHEMBL20291400 | 0.87 | BRD4 (0.80) | ALDH1A1BRD4BRD2HCRTR1HCRTR2 | |
| SCHEMBL32691722 | 0.86 | ALDH1A1 (0.70) | ALDH1A1HTTHSD11B1MEN1KMT2A | |
| SCHEMBL6962263 | 0.86 | ALDH1A1 (0.72) | ALDH1A1HTTTDP1L3MBTL1 | |
| SCHEMBL15648472 | 0.86 | ALDH1A1 (0.72) | ALDH1A1HTTTDP1L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1664010-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | Vernalis (R&D) Limited (GB) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005068448-A1 | SULFONAMIDES ANTAGONISING N-TYPE CALCIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-07-28 | — | — | WO | disclosed |