Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | KIF11 | P52732 | 9/20 | 0.59 |
| ▸ | PEPD | P12955 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5062623 | 0.82 | PEPD (0.80) | NPC1KIF11PEPDALDH1A1GAA | |
| SCHEMBL29078318 | 0.81 | EPHX2 (0.45) | NPC1KIF11ALDH1A1MAPTMEN1 | |
| SCHEMBL2191366 | 0.79 | KIF11 (0.89) | NPC1KIF11PEPDALDH1A1MAPT | |
| SCHEMBL167549 | 0.79 | KIF11 (0.89) | NPC1KIF11PEPDALDH1A1MAPT | |
| SCHEMBL11626028 | 0.76 | KIF11 (0.60) | NPC1KIF11PEPDALDH1A1GAA | |
| SCHEMBL224279 | 0.76 | NPC1 (1.00) | NPC1KIF11PEPDALDH1A1GAA | |
| SCHEMBL28757317 | 0.75 | NPC1 (0.69) | NPC1MAPTMEN1KMT2A | |
| SCHEMBL5425660 | 0.75 | KIF11 (1.00) | NPC1KIF11PEPDMAPTMEN1 | |
| SCHEMBL261232 | 0.75 | KIF11 (0.64) | NPC1KIF11PEPDALDH1A1GAA | |
| SCHEMBL5427711 | 0.75 | KIF11 (1.00) | KIF11ALDH1A1EPHX2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4431959-B2 | — | — | 2010-03-17 | — | — | JP | claimed |
| EP-1513959-A4 | ANTIVIRAL INHIBITIONS OF CAPSID PROTEINS | UNIV MARYLAND AT BALTIMORE COU (US) | 2008-07-23 | — | — | EP | claimed |
| JP-2005536717-A | — | — | 2005-12-02 | — | — | JP | claimed |
| EP-1513959-A2 | ANTIVIRAL INHIBITIONS OF CAPSID PROTEINS | University of Maryland at Baltimore County (US) | 2005-03-16 | — | — | EP | claimed |
| WO-2003089615-A2 | ANTIVIRAL INHIBITIONS OF CAPSID PROTEINS | UNIVERSITY OF MARYLAND, BALTIMORE COUNTY (US) | 2003-10-30 | — | — | WO | claimed |