Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.38 |
| ▸ | STAT6 | P42226 | 2/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 5/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.34 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 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 | |
|---|---|---|---|---|
| SCHEMBL7674199 | 0.94 | PDE10A (0.39) | PDE10ADGAT1PDE5APDE4BPDE4D | |
| SCHEMBL6859354 | 0.91 | HSD17B10 (0.36) | HSD17B10PDE10ASTAT6PDE5APDE4B | |
| SCHEMBL6638476 | 0.90 | HSD17B10 (0.40) | HSD17B10PDE10ASTAT6PDE5APDE4B | |
| Bicarbonate SCHEMBL6638241 | 0.89 | PDE5A (0.46) | HSD17B10PDE10ASTAT6PDE5APDE4B | |
| SCHEMBL6858279 | 0.89 | PDE5A (0.42) | PDE5A | |
| SCHEMBL6858238 | 0.88 | PDE5A (0.41) | PDE10ADGAT1PDE5APDE4BPDE4D | |
| SCHEMBL6861041 | 0.88 | TRPV1 (0.40) | — | |
| SCHEMBL7680595 | 0.88 | PDE5A (0.36) | PDE10ADGAT1PDE5AALDH1A1 | |
| SCHEMBL7403578 | 0.87 | PDE5A (0.46) | HSD17B10PDE10ASTAT6PDE5APDE4B | |
| SCHEMBL7675129 | 0.87 | MEN1 (0.39) | PDE10ADGAT1PDE5AALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6787548-B1 | CARDIOVASCULAR INSUFFICIENCY AND ERECTILE DYSFUNCTION; 3-(4-(3-CHLORO-4-HYDROXYBENZYLAMINO) BENZO(4,5)THIENO(2,3-D)PYRIMIDIN-2-YL)PROPIONIC ACID | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 2004-09-07 | — | — | US | claimed |
| US-6787548-B1 | CARDIOVASCULAR INSUFFICIENCY AND ERECTILE DYSFUNCTION; 3-(4-(3-CHLORO-4-HYDROXYBENZYLAMINO) BENZO(4,5)THIENO(2,3-D)PYRIMIDIN-2-YL)PROPIONIC ACID | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 2004-09-07 | — | — | US | disclosed |