Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL14101882 | 0.91 | KDM4E (0.39) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14101895 | 0.90 | P2RX7 (0.38) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14101798 | 0.89 | PDE4A (0.38) | PTGS2PTGS1NOTUMPDE4APDE4B | |
| SCHEMBL14101790 | 0.88 | RORC (0.42) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4722703 | 0.88 | P2RX7 (0.41) | PTGS2PTGS1NOTUMARP2RX7 | |
| SCHEMBL4722700 | 0.88 | P2RX7 (0.41) | PTGS2PTGS1NOTUMARP2RX7 | |
| SCHEMBL14101706 | 0.86 | MAPT (0.38) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14101736 | 0.85 | NOTUM (0.37) | NOTUMPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14101732 | 0.85 | PDE4A (0.38) | PTGS2PTGS1NOTUMPDE4APDE4B | |
| SCHEMBL4724195 | 0.84 | F10 (0.42) | PTGS2NOTUMPDE4APDE4BPDE4C |
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 |