Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 3/20 | 0.57 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.57 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.57 |
| ▸ | BRD4 | O60885 | 3/20 | 0.56 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MMP1 | P03956 | 1/20 | 0.55 |
| ▸ | MMP3 | P08254 | 1/20 | 0.55 |
| ▸ | MMP7 | P09237 | 1/20 | 0.55 |
| ▸ | MMP13 | P45452 | 1/20 | 0.55 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | BRD2 | P25440 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL20291072 | 0.89 | BRD4 (0.73) | HCRTR1HCRTR2BRD4ALDH1A1KMT2A | |
| SCHEMBL5717004 | 0.88 | CASP3 (0.59) | HCRTR1HCRTR2KCNQ1BRD4CASP3 | |
| SCHEMBL5717102 | 0.87 | ALDH1A1 (0.64) | HCRTR1HCRTR2BRD4ALDH1A1KMT2A | |
| SCHEMBL5717227 | 0.87 | ALDH1A1 (0.64) | HCRTR1HCRTR2BRD4ALDH1A1KMT2A | |
| SCHEMBL5717122 | 0.87 | BRD4 (0.51) | HCRTR1HCRTR2KCNQ1BRD4ALDH1A1 | |
| SCHEMBL5717100 | 0.87 | ALDH1A1 (0.64) | HCRTR1HCRTR2BRD4ALDH1A1KMT2A | |
| SCHEMBL23630452 | 0.85 | ALDH1A1 (0.55) | HCRTR1HCRTR2BRD4ALDH1A1MMP1 | |
| SCHEMBL5716989 | 0.85 | ALDH1A1 (0.66) | HCRTR1HCRTR2KCNQ1BRD4ALDH1A1 | |
| SCHEMBL5716988 | 0.85 | ALDH1A1 (0.66) | HCRTR1HCRTR2KCNQ1BRD4ALDH1A1 | |
| SCHEMBL5717022 | 0.85 | ALDH1A1 (0.66) | HCRTR1HCRTR2KCNQ1BRD4ALDH1A1 |
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 |