Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | PRCP | P42785 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 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 | |
|---|---|---|---|---|
| SCHEMBL6097273 | 0.79 | NOTUM (0.58) | ALDH1A1MAPTTSHRMAPK1MEN1 | |
| SCHEMBL3260780 | 0.76 | PRCP (0.57) | KDM4EMAPTMAPK1PRCPSIGMAR1 | |
| SCHEMBL31073550 | 0.76 | KCNH2 (0.56) | ALDH1A1LMNAL3MBTL1MAPK1BRD4 | |
| SCHEMBL3260783 | 0.76 | PRCP (0.57) | KDM4EMAPTMAPK1PRCPSIGMAR1 | |
| SCHEMBL13589929 | 0.75 | CHRM3 (0.62) | HDAC8PRCPCHRM3CACNA1FCHRM2 | |
| SCHEMBL1566898 | 0.75 | CHRM3 (0.62) | HDAC8PRCPCHRM3CACNA1FCHRM2 | |
| Bicarbonate SCHEMBL376797 | 0.74 | SIGMAR1 (0.55) | MAPK1MAPK14HAO1SIGMAR1MEN1 | |
| Butanedione SCHEMBL17273471 | 0.73 | SIGMAR1 (0.55) | TSHRMAPK1MAPK14HAO1GID4 | |
| SCHEMBL464005 | 0.71 | NOTUM (0.67) | ALDH1A1MAPTMEN1CYP3A4CYP2C19 | |
| SCHEMBL30056523 | 0.71 | NOTUM (0.67) | ALDH1A1MAPTMEN1CYP3A4CYP2C19 |
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-2010012812-A1 | BENZAZEPINES AND BENZAZOCINES AS SIGMA-RECEPTOR LIGANDES | Westfälische Wilhelms Universität Münster (DE) | 2010-02-04 | — | — | WO | disclosed |