Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939865 | 0.87 | NPSR1 (0.51) | NPSR1MAPTSIGMAR1ALDH1A1 | |
| SCHEMBL14939458 | 0.87 | NPSR1 (0.52) | NPSR1MAPTSIGMAR1DRD2HTR2B | |
| SCHEMBL14939424 | 0.87 | NPSR1 (0.68) | NPSR1MMP2MMP9MAPTSIGMAR1 | |
| SCHEMBL14940030 | 0.87 | NPSR1 (0.68) | NPSR1MMP2MMP9MAPTSIGMAR1 | |
| SCHEMBL14939890 | 0.86 | NPSR1 (0.49) | NPSR1MAPTTRPC5LMNACYP2D6 | |
| SCHEMBL14939297 | 0.85 | NPSR1 (0.48) | NPSR1MAPTTRPC5LMNA | |
| SCHEMBL14939840 | 0.85 | NPSR1 (0.77) | NPSR1MMP2MMP9MAPTSIGMAR1 | |
| SCHEMBL14939690 | 0.83 | NPSR1 (0.77) | NPSR1MMP2MMP9MAPTLMNA | |
| SCHEMBL14939364 | 0.83 | NPSR1 (0.46) | NPSR1MAPTDRD2HTR2BALDH1A1 | |
| SCHEMBL14939617 | 0.82 | NPSR1 (1.00) | NPSR1MMP2MMP9MAPTSIGMAR1 |
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 2 patents. 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 | claimed |
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |