Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 6/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 4/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL25883473 | 0.82 | NR3C1 (0.45) | NR3C2NR3C1PGRMEN1KMT2A | |
| SCHEMBL9029862 | 0.76 | NR3C2 (0.56) | NR3C2NR3C1PGRMEN1KMT2A | |
| SCHEMBL9029850 | 0.76 | NR3C2 (0.56) | NR3C2NR3C1PGRMEN1KMT2A | |
| SCHEMBL19030251 | 0.73 | DRD2 (0.47) | NR3C2NR3C1PGRMEN1KMT2A | |
| SCHEMBL20804963 | 0.69 | NR3C2 (0.52) | NR3C2NR3C1PGRMEN1KMT2A | |
| SCHEMBL19418129 | 0.68 | ALDH1A1 (0.43) | NR3C2NR3C1L3MBTL1KDM4EHTT | |
| Diethylamine SCHEMBL9700231 | 0.68 | SMN1; SMN2 (0.45) | MEN1KMT2ACA2L3MBTL1ALDH1A1 | |
| SCHEMBL3485497 | 0.67 | NR3C2 (0.38) | NR3C2NR3C1PGRCA2DRD2 | |
| SCHEMBL30457404 | 0.67 | ADRA2A (0.39) | HCRTR2CA2AKR1B1 | |
| SCHEMBL25723206 | 0.67 | ADRA2A (0.39) | HCRTR2CA2AKR1B1 |
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-2925757-B1 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | NOVARTIS AG (CH) | 2017-10-04 | — | — | EP | disclosed |