Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 9/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.53 |
| ▸ | PTGER4 | P35408 | 5/20 | 0.51 |
| ▸ | PDE8B | O95263 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28875152 | 0.88 | AKR1C3 (0.44) | AKR1C3AKR1C2PTGER4ALOX15MEN1 | |
| SCHEMBL1412486 | 0.86 | UCHL1 (0.52) | AKR1C3AKR1C2PTGER4PDE8BALOX15 | |
| SCHEMBL27830557 | 0.86 | PTGER4 (0.53) | AKR1C3PTGER4 | |
| SCHEMBL939419 | 0.84 | HPGD (0.51) | AKR1C3AKR1C2PTGER4ALDH1A1 | |
| SCHEMBL27830494 | 0.83 | AKR1C3 (0.51) | AKR1C3AKR1C2PTGER4PDE8BALOX15 | |
| SCHEMBL22815854 | 0.83 | AKR1C3 (0.49) | AKR1C3AKR1C2PTGER4PDE8BALOX15 | |
| SCHEMBL22816780 | 0.83 | AKR1C3 (0.48) | AKR1C3AKR1C2PTGER4PDE8BALOX15 | |
| SCHEMBL22815934 | 0.82 | AKR1C3 (0.48) | AKR1C3AKR1C2PTGER4ALOX15L3MBTL1 | |
| SCHEMBL15243013 | 0.81 | AKR1C3 (0.52) | AKR1C3AKR1C2PTGER4PDE8BALOX15 | |
| SCHEMBL27830497 | 0.80 | ALOX15 (0.52) | AKR1C3AKR1C2PDE8BALOX15L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102336718-A | Fluorine-containing triazole derivatives and preparation method thereof | UNIV SHANGHAI | 2012-02-01 | — | — | CN | disclosed |