Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPID | Q08752 | 2/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 2/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
| ▸ | FPR3 | P25089 | 1/20 | 0.44 |
| ▸ | FPR2 | P25090 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL12643841 | 0.90 | PPID (0.53) | PPIDPTPN1NAMPTCYP17A1MAPKAPK2 | |
| SCHEMBL14576001 | 0.84 | PPID (0.73) | PPIDPTPN1NAMPTCYP17A1MAPKAPK2 | |
| SCHEMBL3462483 | 0.82 | NPC1 (0.60) | PTPN1NAMPTMAPKAPK2NPC1HDAC1 | |
| SCHEMBL15359168 | 0.81 | CYP17A1 (0.51) | NAMPTCYP17A1MAPKAPK2HDAC1HDAC6 | |
| SCHEMBL16523129 | 0.80 | CYP17A1 (0.56) | PPIDPTPN1NAMPTCYP17A1MAPKAPK2 | |
| SCHEMBL19882169 | 0.80 | NAMPT (0.46) | NAMPTCYP17A1MAPKAPK2HDAC1HDAC6 | |
| SCHEMBL12643659 | 0.79 | MAPT (0.49) | PTPN1NAMPTCYP17A1MAPKAPK2NPC1 | |
| SCHEMBL8245694 | 0.79 | CYP17A1 (0.54) | NAMPTCYP17A1MAPKAPK2NPC1HDAC1 | |
| SCHEMBL4922883 | 0.78 | NAMPT (0.63) | PTPN1NAMPTNPC1HDAC1MAPT | |
| SCHEMBL21661941 | 0.78 | HDAC6 (0.63) | NAMPTCYP17A1NPC1HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2516387-B1 | INHIBITORS OF CYCLOPHILINS FOR USE IN THE PREVENTION AND/OR THE TREATMENT OF VIRAL PATHOLOGIES OR INFECTIONS | INSTITUT NATIONAL DE LA SANTÉ ET DE LA RECH MÉDICALE (INSERM) (FR) | 2018-02-21 | — | — | EP | disclosed |