Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 7/20 | 0.38 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4721889 | 0.90 | SMN1; SMN2 (0.32) | BRD4EPHX2AGTR1AGTR2KDM4E | |
| SCHEMBL4721552 | 0.89 | SCD (0.40) | EPHX2KDM4EKMT2A | |
| SCHEMBL4720999 | 0.89 | PDE4A (0.35) | BRD4RAF1BRAFEPHX2AGTR1 | |
| SCHEMBL4719833 | 0.88 | PDE4A (0.35) | KDM4EKMT2A | |
| SCHEMBL4765721 | 0.88 | PDE4A (0.36) | KDM4EKMT2A | |
| SCHEMBL4722084 | 0.88 | PDE4A (0.35) | KDM4EKMT2A | |
| SCHEMBL4720622 | 0.87 | AAK1 (0.34) | RAF1BRAFEPHX2KMT2A | |
| SCHEMBL4722253 | 0.87 | PDE4A (0.35) | KDM4EKMT2A | |
| SCHEMBL4723364 | 0.87 | PDE4A (0.35) | KDM4EKMT2A | |
| SCHEMBL4721809 | 0.87 | SCD (0.41) | KDM4EKMT2A |
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 |