Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 5/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4036344 | 0.80 | SMPD3 (0.41) | TSHREGFRPTGDR2LMNASMN1; SMN2 | |
| SCHEMBL1308980 | 0.79 | SMPD3 (0.40) | TSHREGFRALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL1306317 | 0.77 | TUBB4A (0.47) | PDE5ALMNAHPGDSMN1; SMN2MAPT | |
| SCHEMBL4034103 | 0.75 | SMPD3 (0.40) | TSHRPTGDR2LMNAMAPT | |
| SCHEMBL4034089 | 0.74 | SMPD3 (0.46) | TSHRPTGDR2LMNASMN1; SMN2MAPT | |
| SCHEMBL4042076 | 0.74 | MAPT (0.39) | TSHREGFRPTGDR2MAPTFGFR1 | |
| SCHEMBL4034301 | 0.74 | GABRA1 (0.41) | PTGDR2ALDH1A1MAPT | |
| SCHEMBL4042546 | 0.74 | MAPT (0.43) | TSHREGFRPTGDR2MAPTFGFR1 | |
| SCHEMBL4040171 | 0.73 | TUBB4A (0.41) | TSHRPTGDR2ALDH1A1LMNAMAPT | |
| SCHEMBL15225671 | 0.73 | SMPD3 (0.40) | TSHRPTGDR2LMNASMN1; SMN2MAPT |
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-2086942-A2 | NOVEL COMPOUNDS | Glaxo Group Limited (GB) | 2009-08-12 | — | — | EP | disclosed |
| WO-2008043788-A2 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2008-04-17 | — | — | WO | disclosed |