Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19955442 | 0.84 | MAOA (0.46) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL17399834 | 0.82 | CYP2C19 (0.53) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL27634334 | 0.79 | POLB (0.54) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL9377084 | 0.72 | POLB (0.54) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL11519154 | 0.72 | CYP2C19 (0.53) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL4732713 | 0.72 | KDM4E (0.54) | CYP2C19POLBALDH1A1HPGDTSHR | |
| SCHEMBL11593694 | 0.70 | POLB (0.56) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL30346643 | 0.70 | POLB (0.56) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL22299425 | 0.70 | CYP2C19 (0.61) | CYP2C19POLBALDH1A1HPGDMAOA | |
| SCHEMBL13602368 | 0.70 | PKM (0.49) | CYP2C19POLBALDH1A1HPGDMAOA |
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-2663549-B1 | PHENETHYLSULFONE ISOINDOLINE DERIVATIVES AS INHIBITORS OF PDE 4 AND/OR CYTOKINES | CELGENE CORP (US) | 2018-03-14 | — | — | EP | disclosed |