Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939475 | 0.89 | NPSR1 (0.58) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939432 | 0.87 | NPSR1 (0.68) | NPSR1SIGMAR1ALDH1A1LMNAMAPT | |
| SCHEMBL14940026 | 0.87 | NPSR1 (0.56) | NPSR1SIGMAR1ALDH1A1ALDH3A1KDM4E | |
| SCHEMBL14939713 | 0.85 | NPSR1 (0.65) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14940106 | 0.85 | NPSR1 (0.72) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939758 | 0.84 | NPSR1 (0.63) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939162 | 0.84 | SIGMAR1 (0.51) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939364 | 0.83 | NPSR1 (0.46) | NPSR1ALDH1A1HTTKDM4ETSHR | |
| SCHEMBL14939645 | 0.82 | SIGMAR1 (0.53) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939975 | 0.82 | NPSR1 (0.60) | NPSR1SIGMAR1ALDH1A1ALDH3A1LMNA |
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 |