Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.41 |
| ▸ | ITGAL | P20701 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CRHBP | P24387 | 2/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | OXTR | P30559 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11731713 | 0.72 | LMNA (0.36) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL438269 | 0.71 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL6269163 | 0.69 | LMNA (0.66) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL2422652 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL279547 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL5010225 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL442811 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL29966720 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL1038843 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA | |
| SCHEMBL13950594 | 0.67 | ABCG2 (0.46) | ABCG2ITGB2ICAM1ITGALLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006138265-A2 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS, PREPARATION AND USE THEREOF | SCHERING CORPORATION (US) | 2006-12-28 | — | — | WO | disclosed |