Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 8/20 | 0.39 |
| ▸ | RARA | P10276 | 8/20 | 0.39 |
| ▸ | RARG | P13631 | 7/20 | 0.39 |
| ▸ | RXRA | P19793 | 4/20 | 0.36 |
| ▸ | BRD4 | O60885 | 3/20 | 0.36 |
| ▸ | BRD2 | P25440 | 3/20 | 0.36 |
| ▸ | BRD3 | Q15059 | 3/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | FSHR | P23945 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 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 | |
|---|---|---|---|---|
| SCHEMBL4563416 | 0.92 | LTB4R (0.36) | RARBRARARARGPDE5AHCRTR2 | |
| SCHEMBL4564105 | 0.91 | PDE4A (0.37) | BRD4BRD2BRD3PDE4APDE4B | |
| SCHEMBL4564158 | 0.91 | HTR2B (0.36) | — | |
| SCHEMBL4566136 | 0.88 | PDK2 (0.41) | RARBRARARARG | |
| SCHEMBL4564518 | 0.86 | LTB4R (0.38) | RXRARXRBRXRGFSHRHCRTR2 | |
| SCHEMBL4657250 | 0.86 | LMNA (0.38) | BRD4BRD2BRD3HCRTR2 | |
| SCHEMBL4565660 | 0.86 | PDK2 (0.41) | BRD4BRD2BRD3FSHRPLAU | |
| SCHEMBL4563452 | 0.84 | PTGS2 (0.39) | — | |
| SCHEMBL4627814 | 0.84 | HSP90AA1 (0.34) | — | |
| SCHEMBL4564228 | 0.83 | CACNA1B (0.35) | BRD4BRD2BRD3HCRTR2 |
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 |