Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.74 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.49 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939562 | 0.90 | NPSR1 (0.60) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14939885 | 0.89 | NPSR1 (0.59) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14940333 | 0.87 | NPSR1 (0.57) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14939107 | 0.87 | NPSR1 (0.57) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14940010 | 0.87 | NPSR1 (0.57) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14939967 | 0.87 | NPSR1 (0.57) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14939071 | 0.87 | NPSR1 (0.56) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14938958 | 0.87 | NPSR1 (0.56) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14938960 | 0.86 | NPSR1 (0.55) | NPSR1SIGMAR1KDM4EALDH1A1HTT | |
| SCHEMBL14938779 | 0.86 | NPSR1 (0.65) | NPSR1SIGMAR1KDM4EALDH1A1HTT |
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 |