Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4658821 | 0.86 | HCRTR1 (0.32) | HCRTR1HCRTR2HSP90AA1HTR2BALDH1A1 | |
| SCHEMBL4563416 | 0.81 | LTB4R (0.36) | HCRTR1HCRTR2HSP90AA1HTR2BALDH1A1 | |
| SCHEMBL4629499 | 0.80 | HSP90AA1 (0.39) | HSP90AA1ALDH1A1GAAL3MBTL1KMT2A | |
| SCHEMBL4564085 | 0.80 | HSP90AA1 (0.39) | HSP90AA1ALDH1A1GAAL3MBTL1MEN1 | |
| SCHEMBL4564083 | 0.80 | TSHR (0.42) | HCRTR1HCRTR2HSP90AA1HTR2BALDH1A1 | |
| SCHEMBL4564518 | 0.80 | LTB4R (0.38) | HCRTR1HCRTR2 | |
| SCHEMBL4627927 | 0.80 | ALDH1A1 (0.37) | HSP90AA1HTR2BALDH1A1GAAL3MBTL1 | |
| SCHEMBL4556263 | 0.80 | ALDH1A1 (0.37) | HSP90AA1HTR2BALDH1A1GAAL3MBTL1 | |
| SCHEMBL4564158 | 0.79 | HTR2B (0.36) | HSP90AA1HTR2BALDH1A1GAAL3MBTL1 | |
| SCHEMBL4658817 | 0.79 | NAMPT (0.32) | HSP90AA1PSMB5 |
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-1907395-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2008-04-09 | — | — | EP | disclosed |
| WO-2007002867-A1 | ABCA1 ELEVATING COMPOUNDS | CV THERAPEUTICS, INC. (US) | 2007-01-04 | — | — | WO | disclosed |