Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL6256411 | 0.84 | PDE10A (0.44) | PDE10AMAPTPTPN1FGFR1SRC | |
| SCHEMBL3960133 | 0.82 | PDE10A (0.51) | PDE10AMAPTFGFR1SRCALDH1A1 | |
| SCHEMBL3960135 | 0.82 | PDE10A (0.51) | PDE10AMAPTFGFR1SRCALDH1A1 | |
| SCHEMBL5901373 | 0.82 | PDE10A (0.51) | PDE10AMAPTFGFR1SRCALDH1A1 | |
| SCHEMBL5227730 | 0.73 | TDP1 (0.51) | MAPTFGFR1SRCALDH1A1CYP3A4 | |
| SCHEMBL5901755 | 0.71 | CA12 (0.46) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL5993543 | 0.71 | PDE10A (0.49) | PDE10AMAPTALDH1A1CYP3A4TP53 | |
| SCHEMBL5901372 | 0.71 | PDE10A (0.49) | PDE10AMAPTALDH1A1CYP3A4TP53 | |
| SCHEMBL5228972 | 0.69 | FGFR1 (0.50) | MAPTPTPN1FGFR1SRCALDH1A1 | |
| SCHEMBL5901698 | 0.69 | FGFR1 (0.50) | MAPTPTPN1FGFR1SRCALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1583760-A2 | SUBSTITUTED HETEROCYCLIC COMPOUNDS | CV Therapeutics Inc. (US) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004067506-A2 | SUBSTITUTED HETEROCYCLIC COMPOUNDS | CV THERAPEUTICS INC. (US) | 2004-08-12 | — | — | WO | disclosed |
| EP-1406898-A1 | SUBSTITUTED PIPERAZINE COMPOUNDS AND THEIR USE AS FATTY ACID OXIDATION INHIBITORS | CV THERAPEUTICS, INC. (US) | 2004-04-14 | — | — | EP | disclosed |
| WO-2003008411-A1 | SUBSTITUTED PIPERAZINE COMPOUNDS AND THEIR USE AS FATTY ACID OXIDATION INHIBITORS | CV THERAPEUTICS, INC. (US) | 2003-01-30 | — | — | WO | disclosed |