Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.48 |
| ▸ | DRD2 | P14416 | 6/20 | 0.48 |
| ▸ | HTR2A | P28223 | 4/20 | 0.48 |
| ▸ | HTR2C | P28335 | 4/20 | 0.48 |
| ▸ | HTR2B | P41595 | 4/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 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 | |
|---|---|---|---|---|
| SCHEMBL14940059 | 0.95 | NPSR1 (0.49) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939744 | 0.93 | LMNA (0.45) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939556 | 0.92 | NPSR1 (0.53) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939854 | 0.91 | CHRM2 (0.43) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939526 | 0.91 | NPSR1 (0.46) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14938869 | 0.90 | SIGMAR1 (0.48) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939177 | 0.89 | NPSR1 (0.54) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939332 | 0.89 | SIGMAR1 (0.43) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939852 | 0.88 | NPSR1 (0.54) | NPSR1SIGMAR1DRD2HTR2AHTR2C | |
| SCHEMBL14939625 | 0.87 | NPSR1 (0.64) | NPSR1SIGMAR1DRD2HTR2AHTR2C |
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 |