Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | PTPRF | P10586 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2157768 | 0.84 | NR1I2 (0.38) | KDM4EMAPTLMNAPKMRXFP1 | |
| SCHEMBL13093691 | 0.83 | OPRM1 (0.41) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL14049057 | 0.83 | KDM4E (0.44) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL14048974 | 0.82 | OPRM1 (0.41) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL14048975 | 0.82 | KDM4E (0.42) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL14136642 | 0.82 | KDM4E (0.42) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL13355831 | 0.80 | OPRM1 (0.39) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL14048869 | 0.80 | ALDH1A1 (0.42) | KDM4EMAPTMEN1NPC1ALDH1A1 | |
| SCHEMBL2158047 | 0.80 | HCRTR2 (0.42) | — | |
| SCHEMBL14136660 | 0.79 | OPRM1 (0.39) | KDM4EMAPTMEN1NPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7985769-B2 | Compounds and methods for the treatment or prevention of Flavivirus infections | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-07-26 | — | — | US | disclosed |