Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 7/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20198617 | 0.86 | PDE7A (0.36) | PDE7AADORA3PDE7B | |
| SCHEMBL20198618 | 0.86 | PDE7A (0.36) | PDE7AADORA3PDE7B | |
| SCHEMBL20104701 | 0.75 | PDE7A (0.41) | PDE7AADORA3PDE7B | |
| SCHEMBL20104729 | 0.71 | PDE7A (0.38) | PDE7APDE7B | |
| SCHEMBL20104727 | 0.71 | PDE7A (0.38) | PDE7APDE7B | |
| SCHEMBL20469074 | 0.71 | ADORA3 (0.39) | PDE7AADORA3 | |
| SCHEMBL30574138 | 0.71 | ADORA3 (0.39) | PDE7AADORA3 | |
| SCHEMBL20991112 | 0.71 | ADORA3 (0.39) | PDE7AADORA3 | |
| SCHEMBL1743215 | 0.71 | ADORA3 (0.39) | PDE7AADORA3 | |
| SCHEMBL23740200 | 0.70 | ADORA3 (0.33) | PDE7AADORA3 |
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-11195597-B2 | Method and device for calculating acid dissociation constant, and program | FUJITSU LIMITED (JP) | 2021-12-07 | — | — | US | disclosed |
| US-20180121632-A1 | METHOD AND DEVICE FOR CALCULATING ACID DISSOCIATION CONSTANT, AND PROGRAM | FUJITSU LIMITED (JP) | 2018-05-03 | — | — | US | disclosed |