Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.68 |
| ▸ | GUCY1A1 | Q02108 | 12/20 | 0.54 |
| ▸ | GUCY1B1 | Q02153 | 12/20 | 0.54 |
| ▸ | PDE5A | O76074 | 6/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL5763523 | 0.92 | ADORA3 (0.70) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL255819 | 0.91 | ADORA3 (0.78) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL5765138 | 0.90 | ADORA3 (0.73) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL7509551 | 0.89 | ADORA3 (0.55) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL460196 | 0.89 | ADORA3 (0.69) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL460864 | 0.88 | ADORA3 (0.68) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL174220 | 0.88 | ADORA3 (0.68) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL30507540 | 0.87 | ADORA3 (0.82) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL174915 | 0.87 | ADORA3 (0.82) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL459275 | 0.86 | ADORA3 (0.66) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A |
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-9096592-B2 | Bicyclic aza heterocycles, and use thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-08-04 | — | — | US | disclosed |
| WO-2012010576-A1 | CARBAMATE-SUBSTITUTED DIAMINOPYRIMIDINES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-01-26 | — | — | WO | disclosed |