Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.81 |
| ▸ | MAPT | P10636 | 10/20 | 0.81 |
| ▸ | HTT | P42858 | 3/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.74 |
| ▸ | MEN1 | O00255 | 9/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.74 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.74 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.74 |
| ▸ | TSHR | P16473 | 3/20 | 0.74 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.72 |
| ▸ | LMNA | P02545 | 3/20 | 0.72 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.71 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.71 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.71 |
| ▸ | HPGD | P15428 | 10/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.67 |
| ▸ | RECQL | P46063 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.65 |
| ▸ | STAT6 | P42226 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL6254233 | 0.91 | ALDH1A1 (0.68) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL7016994 | 0.83 | ADORA1 (1.00) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL13913671 | 0.82 | ADORA1 (0.71) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL2279737 | 0.80 | ADORA1 (0.80) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL6441319 | 0.80 | ADORA1 (0.69) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL5040253 | 0.80 | ALDH1A1 (0.85) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL18313857 | 0.80 | ALDH1A1 (0.64) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL13913723 | 0.79 | ALDH1A1 (0.71) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL6442951 | 0.79 | KDM4E (0.68) | ALDH1A1MAPTHTTKDM4EMEN1 | |
| SCHEMBL4471026 | 0.79 | ALDH1A1 (0.76) | ALDH1A1MAPTKDM4EMEN1KMT2A |
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-2005058315-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS IKK2 INHIBITORS WITH ANTI-HBV ACTIVITY | RIBAPHARM, INC. (US) | 2005-06-30 | — | — | WO | disclosed |