Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | USP7 | Q93009 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12517343 | 1.00 | ALDH1A1 (0.54) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL3955431 | 0.77 | USP7 (0.53) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL3960626 | 0.71 | USP7 (0.53) | ALDH1A1NPSR1KDM4EUSP7MAPT | |
| SCHEMBL12517344 | 0.70 | KDM4E (0.59) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL2229210 | 0.70 | KDM4E (0.59) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL12517349 | 0.68 | ALDH1A1 (0.78) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL2228146 | 0.68 | ALDH1A1 (0.78) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL12517342 | 0.68 | KDM4E (0.60) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL2227307 | 0.68 | KDM4E (0.60) | ALDH1A1NPSR1HPGDALOX15KDM4E | |
| SCHEMBL12517662 | 0.68 | ALDH1A1 (0.50) | ALDH1A1NPSR1HPGDALOX15KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011089457-A1 | NOVEL MEDICINAL COMPOUNDS | URATIM GYÁRTÓ KORLÁTOLT FELELŐSSÉGŰ TÁRSASÁG (HU) | 2011-07-28 | — | — | WO | claimed |
| WO-2011089457-A1 | NOVEL MEDICINAL COMPOUNDS | URATIM GYÁRTÓ KORLÁTOLT FELELŐSSÉGŰ TÁRSASÁG (HU) | 2011-07-28 | — | — | WO | disclosed |