Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.36 |
| ▸ | DRD1 | P21728 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 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 | |
|---|---|---|---|---|
| SCHEMBL1699476 | 0.90 | PDE10A (0.36) | PDE10ADRD1PDE4BLMNA | |
| SCHEMBL1699084 | 0.86 | DRD1 (0.39) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL1699098 | 0.83 | DRD1 (0.44) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL1699248 | 0.80 | DRD1 (0.38) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL1699092 | 0.79 | DRD1 (0.38) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL1699250 | 0.79 | PDE10A (0.36) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL14889112 | 0.79 | DRD1 (0.38) | PDE10ADRD1MEN1KMT2APDE4B | |
| SCHEMBL1699557 | 0.76 | HDAC1 (0.37) | PDE10ADRD1MEN1KMT2APOLB | |
| SCHEMBL1699234 | 0.74 | L3MBTL1 (0.54) | LMNA | |
| SCHEMBL1699205 | 0.73 | MEN1 (0.43) | MEN1KMT2AUSP2ALDH1A1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2585462-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2013-05-01 | — | — | EP | disclosed |
| WO-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |