Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28289900 | 0.78 | USP7 (0.41) | TP53CSNK1A1CLK4HSD17B10ALDH1A1 | |
| SCHEMBL8320187 | 0.75 | MAPK1 (0.42) | TP53CSNK1A1CLK4HSD17B10ALOX15 | |
| SCHEMBL9067611 | 0.74 | TP53 (0.43) | TP53CSNK1A1CLK4 | |
| SCHEMBL8321298 | 0.73 | KDM4E (0.45) | CSNK1A1CLK4HSD17B10ALDH1A1KDM4E | |
| SCHEMBL10696235 | 0.72 | TP53 (0.57) | TP53CSNK1A1CLK4HSD17B10ALOX15 | |
| SCHEMBL11598649 | 0.72 | TP53 (0.43) | TP53CSNK1A1CLK4HSD17B10ALOX15 | |
| SCHEMBL8653737 | 0.71 | KDM4E (0.37) | HSD17B10ALOX15ALDH1A1KDM4EMAPT | |
| SCHEMBL27883134 | 0.71 | CSNK1A1 (0.47) | TP53CSNK1A1CLK4KDM4EGAA | |
| SCHEMBL11812461 | 0.70 | MAPK1 (0.40) | TP53HSD17B10ALOX15ALDH1A1KDM4E | |
| SCHEMBL10690802 | 0.68 | KDM4E (0.44) | TP53CSNK1A1CLK4HSD17B10ALDH1A1 |
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-5536724-A | Antiinflammatory and antineoplastic 5-deazaaminopterins and 5,10-dideazaaminopterins | SRI INTERNATIONAL (US) | 1996-07-16 | — | — | US | disclosed |