Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.50 |
| ▸ | HTR2B | P41595 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939907 | 0.96 | SIGMAR1 (0.55) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14939591 | 0.93 | SIGMAR1 (0.50) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14939908 | 0.90 | SIGMAR1 (0.51) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14940465 | 0.89 | SIGMAR1 (0.50) | SIGMAR1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL14939485 | 0.89 | SIGMAR1 (0.51) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14940496 | 0.88 | ACHE (0.52) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14939017 | 0.87 | HTR7 (0.48) | SIGMAR1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL14938846 | 0.87 | ALDH1A1 (0.41) | SIGMAR1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL14939777 | 0.86 | NPSR1 (0.54) | SIGMAR1NPSR1DRD2HTR2AHTR2C | |
| SCHEMBL14939466 | 0.86 | NPSR1 (0.54) | SIGMAR1NPSR1DRD2HTR2AHTR2C |
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 |