Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.75 |
| ▸ | MAPT | P10636 | 11/20 | 0.75 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.75 |
| ▸ | HPGD | P15428 | 9/20 | 0.75 |
| ▸ | GAA | P10253 | 7/20 | 0.75 |
| ▸ | BLM | P54132 | 6/20 | 0.75 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.75 |
| ▸ | SAE1 | Q9UBE0 | 6/20 | 0.75 |
| ▸ | UBA2 | Q9UBT2 | 6/20 | 0.75 |
| ▸ | HTT | P42858 | 6/20 | 0.75 |
| ▸ | MEN1 | O00255 | 5/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.75 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.75 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.75 |
| ▸ | THRB | P10828 | 4/20 | 0.75 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.75 |
| ▸ | PLEC | Q15149 | 3/20 | 0.75 |
| ▸ | UBE2I | P63279 | 3/20 | 0.75 |
| ▸ | NSD2 | O96028 | 3/20 | 0.75 |
| ▸ | TDP2 | O95551 | 2/20 | 0.75 |
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 | |
|---|---|---|---|---|
| SCHEMBL16772922 | 0.85 | KDM4E (0.55) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15256901 | 0.85 | KDM4E (1.00) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15256904 | 0.79 | KDM4E (0.89) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15256919 | 0.79 | KDM4E (0.68) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL19742978 | 0.78 | SAE1 (0.70) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15256869 | 0.71 | KDM4E (0.75) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15256897 | 0.70 | HPGD (1.00) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL15032608 | 0.70 | ALDH1A1 (0.71) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL6981812 | 0.70 | SAE1 (0.89) | ALDH1A1MAPTKDM4EHPGDGAA | |
| SCHEMBL6981187 | 0.66 | KDM4E (1.00) | ALDH1A1MAPTKDM4EHPGDGAA |
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-9045483-B2 | Inhibition of small ubiquitin-like modifier enzymes with substituted pyrrolo[2,3-b]quinoxalines | CITY OF HOPE (US) | 2015-06-02 | — | — | US | disclosed |