Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939885 | 0.89 | NPSR1 (0.59) | NPSR1MAPTSIGMAR1OPRM1ALDH1A1 | |
| SCHEMBL14939158 | 0.88 | NPSR1 (0.55) | NPSR1MAPTALDH1A1KDM4EMEN1 | |
| SCHEMBL14940377 | 0.87 | NPSR1 (0.74) | NPSR1MAPTSIGMAR1ALDH1A1KDM4E | |
| SCHEMBL14939875 | 0.87 | NPSR1 (0.54) | NPSR1MAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL14939967 | 0.87 | NPSR1 (0.57) | NPSR1MAPTSIGMAR1OPRM1ALDH1A1 | |
| SCHEMBL14939107 | 0.87 | NPSR1 (0.57) | NPSR1MAPTSIGMAR1OPRM1ALDH1A1 | |
| SCHEMBL14939840 | 0.86 | NPSR1 (0.77) | NPSR1MAPTSIGMAR1KDM4EKMT2A | |
| SCHEMBL14939865 | 0.86 | NPSR1 (0.51) | NPSR1MAPTSIGMAR1OPRM1ALDH1A1 | |
| SCHEMBL14939285 | 0.84 | NPSR1 (0.54) | NPSR1MAPTSIGMAR1OPRM1ALDH1A1 | |
| SCHEMBL14940311 | 0.84 | NPSR1 (0.51) | NPSR1MAPTALDH1A1KDM4ECHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |