Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.41 |
| ▸ | SCD | O00767 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL289680 | 0.80 | KDM4E (0.60) | NPC1HPGDGAAKDM4EALDH1A1 | |
| SCHEMBL26005287 | 0.80 | NPC1 (0.76) | NPC1HPGDGAAKDM4EALDH1A1 | |
| SCHEMBL289847 | 0.80 | KDM4E (0.64) | NPC1HPGDKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL298546 | 0.78 | MAPK1 (0.56) | HPGDKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL289905 | 0.77 | HPGD (0.60) | NPC1HPGDGAAKDM4EALDH1A1 | |
| SCHEMBL2809700 | 0.73 | HTR2C (0.56) | HPGDKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL11398081 | 0.72 | CYP1A2 (0.77) | NPC1HPGDGAAKDM4EALDH1A1 | |
| SCHEMBL13754002 | 0.72 | NPC1 (0.59) | NPC1HPGDGAAALDH1A1SMN1; SMN2 | |
| SCHEMBL3587397 | 0.69 | ALDH1A1 (0.72) | NPC1HPGDGAAKDM4EALDH1A1 | |
| SCHEMBL16315254 | 0.69 | GAA (0.69) | NPC1HPGDGAAKDM4EALDH1A1 |
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-2427447-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | Pike Pharma GmbH (CH) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128163-A2 | SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION | PIKE PHARMA GMBH (CH) | 2010-11-11 | — | — | WO | disclosed |