Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | CCR8 | P51685 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 2/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.34 |
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939260 | 0.87 | NPSR1 (0.49) | NPSR1PARP1KDM4EALDH1A1KMT2A | |
| SCHEMBL14939356 | 0.85 | NPSR1 (0.58) | NPSR1CCR8KCNH2KDM4EALDH1A1 | |
| SCHEMBL14938910 | 0.84 | NPSR1 (0.46) | NPSR1KDM4EALDH1A1KMT2ADRD2 | |
| SCHEMBL14939481 | 0.83 | NPSR1 (0.46) | NPSR1KDM4EALDH1A1KMT2AMEN1 | |
| SCHEMBL14939710 | 0.82 | NPSR1 (0.46) | NPSR1ALDH1A1KMT2AMEN1DRD4 | |
| SCHEMBL14939499 | 0.80 | NPSR1 (0.55) | NPSR1KDM4EALDH1A1HTTPOLB | |
| SCHEMBL14939244 | 0.80 | NPSR1 (0.71) | NPSR1KMT2ALMNACYP2D6MAPT | |
| SCHEMBL14939899 | 0.79 | NPSR1 (0.48) | NPSR1HTTKMT2ALMNAMAPT | |
| SCHEMBL14939765 | 0.79 | NPSR1 (0.46) | NPSR1KCNH2KDM4EALDH1A1POLB | |
| SCHEMBL14939940 | 0.79 | NPSR1 (0.47) | NPSR1KMT2ALMNACYP2D6MAPT |
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 |