Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | RBP1 | P09455 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14878718 | 1.00 | CACNA2D1 (0.43) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL13526176 | 1.00 | CACNA2D1 (0.43) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL2834497 | 0.80 | CFD (0.43) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL27831788 | 0.80 | CFD (0.43) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL522925 | 0.80 | NPC1 (0.48) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL1200623 | 0.80 | NPC1 (0.48) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL4156 | 0.80 | NPC1 (0.48) | CACNA2D1HTR2AHRH1ALOX5TP53 | |
| SCHEMBL15247733 | 0.79 | CARM1 (0.46) | CACNA2D1HTR2ATP53LMNAPOLB | |
| SCHEMBL15247731 | 0.79 | CARM1 (0.46) | CACNA2D1HTR2ATP53LMNAPOLB | |
| SCHEMBL4619913 | 0.79 | NPC1 (0.47) | CACNA2D1HTR2AHRH1ALOX5TP53 |
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-2132192-B1 | NOVEL PROCESS FOR PREPARATION OF DULOXETINE HYDROCHLORIDE | LUPIN LTD (IN) | 2013-04-24 | — | — | EP | disclosed |