Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.73 |
| ▸ | MMP2 | P08253 | 2/20 | 0.46 |
| ▸ | MMP9 | P14780 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939404 | 0.89 | NPSR1 (0.57) | NPSR1LMNAMAPTTDP1ALDH1A1 | |
| SCHEMBL14939249 | 0.86 | NPSR1 (0.54) | NPSR1LMNAL3MBTL1ALDH1A1GAA | |
| SCHEMBL14940046 | 0.86 | NPSR1 (0.54) | NPSR1LMNAMAPTALDH1A1TSHR | |
| SCHEMBL14939688 | 0.86 | NPSR1 (0.77) | NPSR1MMP2MMP9LMNAMAPT | |
| SCHEMBL14939617 | 0.85 | NPSR1 (1.00) | NPSR1MMP2MMP9LMNAMAPT | |
| SCHEMBL14939390 | 0.85 | NPSR1 (0.75) | NPSR1MMP2MMP9LMNAMAPT | |
| SCHEMBL14939167 | 0.84 | NPSR1 (0.70) | NPSR1MMP2MMP9LMNAMAPT | |
| SCHEMBL14939081 | 0.84 | NPSR1 (0.56) | NPSR1LMNAMAPTALDH1A1 | |
| SCHEMBL14939244 | 0.83 | NPSR1 (0.71) | NPSR1MMP2MMP9LMNAMAPT | |
| SCHEMBL14939433 | 0.82 | NPSR1 (0.59) | NPSR1LMNAMAPTTDP1ALDH1A1 |
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 |