Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 4/20 | 0.45 |
| ▸ | CASP3 | P42574 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.39 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1844382 | 0.95 | NPC1 (0.46) | ARCASP3NPC1MAPTKMT2A | |
| SCHEMBL31493403 | 0.94 | AR (0.47) | ARCASP3NPC1MAPTKMT2A | |
| SCHEMBL1847823 | 0.87 | ALDH1A1 (0.37) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL6825077 | 0.77 | AR (0.45) | ARNPC1MAPTCACNA1FADORA3 | |
| SCHEMBL31493404 | 0.75 | KMT2A (0.48) | CASP3MAPTKMT2APOLBMEN1 | |
| SCHEMBL1298878 | 0.75 | NPC1 (0.52) | ARNPC1MAPTKMT2APOLB | |
| SCHEMBL1844219 | 0.74 | AR (0.46) | ARCASP3NPC1MAPTCACNA1F | |
| SCHEMBL3477514 | 0.73 | AR (0.57) | ARNPC1MAPTPOLBCACNA1F | |
| SCHEMBL30211543 | 0.71 | NPC1 (0.48) | ARNPC1MAPTKMT2APOLB | |
| SCHEMBL5889676 | 0.70 | NPC1 (0.47) | ARNPC1MAPTKMT2APOLB |
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-1467969-A2 | DNA MINOR GROOVE BINDING COMPOUNDS | The University of Strathclyde (GB) | 2004-10-20 | — | — | EP | disclosed |
| WO-2003059881-A2 | DNA MINOR GROOVE BINDING COMPOUNDS | UNIVERSITY OF STRATHCLYDE (GB) | 2003-07-24 | — | — | WO | disclosed |