Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.40 |
| ▸ | ACHE | P22303 | 6/20 | 0.38 |
| ▸ | APP | P05067 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 3/20 | 0.38 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6859891 | 0.91 | KMT2A (0.40) | TRPV1ACHEAPPBCHESSTR5 | |
| SCHEMBL6858279 | 0.90 | PDE5A (0.42) | — | |
| Bicarbonate SCHEMBL6638242 | 0.90 | PDE5A (0.43) | TRPV1ACHEAPPBCHESSTR5 | |
| SCHEMBL6860760 | 0.89 | KMT2A (0.40) | TRPV1ACHEAPPBCHESSTR5 | |
| SCHEMBL6852827 | 0.88 | HSD17B10 (0.39) | — | |
| SCHEMBL6858238 | 0.86 | PDE5A (0.41) | — | |
| SCHEMBL7674199 | 0.85 | PDE10A (0.39) | — | |
| SCHEMBL6859354 | 0.85 | HSD17B10 (0.36) | — | |
| SCHEMBL7680595 | 0.84 | PDE5A (0.36) | KMT2A | |
| SCHEMBL6858363 | 0.84 | PDE5A (0.41) | — |
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 1 patent. 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 | disclosed |