Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 12/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 12/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.40 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.37 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28169943 | 0.81 | PDE3B (0.42) | PDE3BPDE3AAKR1C3AKR1C2TRPV1 | |
| SCHEMBL17891892 | 0.75 | PDE3B (0.44) | PDE3BPDE3AAKR1C3AKR1C2S1PR1 | |
| SCHEMBL17831713 | 0.75 | PDE3B (0.44) | PDE3BPDE3AAKR1C3AKR1C2S1PR1 | |
| SCHEMBL27664126 | 0.74 | AKR1C3 (0.50) | AKR1C3AKR1C2TRPV1AKR1C4AKR1C1 | |
| SCHEMBL28853162 | 0.74 | AKR1C3 (0.48) | AKR1C3AKR1C2AKR1C4AKR1C1 | |
| SCHEMBL27782035 | 0.73 | AKR1C3 (0.58) | AKR1C3AKR1C2S1PR1 | |
| SCHEMBL25530531 | 0.71 | PDE3B (0.45) | PDE3BPDE3ATRPV1 | |
| SCHEMBL27664095 | 0.71 | AKR1C3 (0.54) | AKR1C3AKR1C2TRPV1AKR1C4AKR1C1 | |
| SCHEMBL27689098 | 0.71 | AKR1C3 (0.48) | AKR1C3AKR1C2AKR1C4AKR1C1 | |
| SCHEMBL17831706 | 0.70 | AKR1C3 (0.47) | AKR1C3AKR1C2AKR1C4AKR1C1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107001286-A | The assimilation compound of dihydro-pyrimidin 2 and its medical usage | 日本烟草产业株式会社 | 2017-08-01 | — | — | CN | disclosed |