Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | COMT | P21964 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL14101794 | 0.89 | PTGS2 (0.42) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL4720636 | 0.88 | P2RX7 (0.42) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL4720633 | 0.88 | P2RX7 (0.42) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL14101796 | 0.88 | PDE4A (0.49) | PDE4APDE4BPDE4CPDE4DMAPT | |
| SCHEMBL14101706 | 0.87 | MAPT (0.38) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL14101895 | 0.86 | P2RX7 (0.38) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL14101882 | 0.86 | KDM4E (0.39) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL14101732 | 0.83 | PDE4A (0.38) | PDE4APDE4BPDE4CPDE4DP2RX7 | |
| SCHEMBL4724195 | 0.83 | F10 (0.42) | PDE4APDE4BPDE4CPDE4DMAPT | |
| SCHEMBL14101790 | 0.83 | RORC (0.42) | PDE4APDE4BPDE4CPDE4DNOTUM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |