Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SNCA | P37840 | 2/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4499060 | 0.79 | CYP1A2 (0.49) | APPMAPTENPP2KDM4ETDO2 | |
| SCHEMBL3303268 | 0.73 | FFAR1 (0.42) | APPBRAFMAPTSNCATGFBR1 | |
| SCHEMBL3078778 | 0.73 | ENPP2 (0.58) | ENPP2KDM4EKCNH2TDO2PIK3CD | |
| SCHEMBL20004343 | 0.72 | APP (0.49) | APPMAPTSNCAALDH1A1 | |
| SCHEMBL4017508 | 0.71 | ADORA3 (0.40) | MAPTENPP2ALDH1A1 | |
| SCHEMBL4017940 | 0.70 | MAPT (0.44) | APPMAPTENPP2PIK3CD | |
| SCHEMBL4015933 | 0.69 | NOTUM (0.46) | MAPTENPP2KDM4ETDO2ALDH1A1 | |
| SCHEMBL21146821 | 0.68 | APP (0.46) | APPMAPTSNCA | |
| SCHEMBL23143419 | 0.67 | ENPP2 (0.47) | MAPTENPP2TDO2PIK3CDTGFBR1 | |
| SCHEMBL28897577 | 0.67 | ENPP2 (0.47) | ENPP2KCNH2TDO2PIK3CDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1613610-B1 | BENZO 1,2,5 OXADIAZOLES AND BENZO 1,2,5 THIADIAZOLES USEFUL AS HISTOPATHOLOGICAL STAINING AGENTS, IMAGING AGENTS AND BIOMARKERS | NOVARTIS AG (CH) | 2009-07-01 | — | — | EP | disclosed |