Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH3A1 | P30838 | 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 | |
|---|---|---|---|---|
| SCHEMBL14940079 | 0.92 | SIGMAR1 (0.50) | NPSR1FAAHHTR1ADRD2ALDH1A1 | |
| SCHEMBL14939769 | 0.85 | NPSR1 (0.62) | NPSR1FAAHHTR1ADRD2HTR2B | |
| SCHEMBL14939501 | 0.83 | HTR1A (0.49) | NPSR1FAAHHTR1ADRD2HTR2B | |
| SCHEMBL14939310 | 0.79 | NPSR1 (0.46) | NPSR1FAAHADAM17ALDH1A1KDM4E | |
| SCHEMBL14939248 | 0.79 | L3MBTL1 (0.53) | FAAHHTR1ADRD2HTR2BALDH1A1 | |
| SCHEMBL14940163 | 0.79 | NPSR1 (0.69) | NPSR1FAAHHTR1ADRD2HTR2B | |
| SCHEMBL14939152 | 0.79 | KDM4E (0.44) | NPSR1HTR1AALDH1A1KDM4ELMNA | |
| SCHEMBL14939086 | 0.75 | SIGMAR1 (0.50) | NPSR1FAAHHTR1ADRD2HTR2B | |
| SCHEMBL14939655 | 0.75 | SIGMAR1 (0.52) | NPSR1FAAHHTR1ADRD2HTR2B | |
| SCHEMBL14939172 | 0.74 | NPSR1 (0.53) | NPSR1FAAHHTR1ADRD2ALDH1A1 |
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 |