Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9182821 | 1.00 | NFE2L2 (0.47) | NFE2L2MAPTNPSR1KDM4EMEN1 | |
| SCHEMBL9435124 | 0.89 | CYP1A2 (0.44) | MAPTNPSR1KDM4ENPC1ALDH1A1 | |
| SCHEMBL9435134 | 0.89 | CYP1A2 (0.44) | MAPTNPSR1KDM4ENPC1ALDH1A1 | |
| SCHEMBL9261050 | 0.84 | SIRT2 (0.42) | MAPTNPSR1MEN1NPC1RAB9A | |
| SCHEMBL9261041 | 0.84 | SIRT2 (0.42) | MAPTNPSR1MEN1NPC1RAB9A | |
| SCHEMBL9186241 | 0.84 | NFE2L2 (0.41) | NFE2L2MAPTNPSR1KDM4EMEN1 | |
| SCHEMBL9186234 | 0.84 | NFE2L2 (0.41) | NFE2L2MAPTNPSR1KDM4EMEN1 | |
| SCHEMBL9259510 | 0.83 | MAOB (0.47) | MAPTNPSR1KDM4ENPC1ALDH1A1 | |
| SCHEMBL9264482 | 0.83 | ERBB2 (0.48) | MAPTNPSR1MEN1NPC1RAB9A | |
| SCHEMBL9259501 | 0.83 | MAOB (0.47) | MAPTNPSR1KDM4ENPC1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1994004513-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1994-03-03 | — | — | WO | claimed |
| EP-0672036-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1995-09-20 | — | — | EP | disclosed |
| WO-1994004513-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1994-03-03 | — | — | WO | disclosed |