Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 9/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 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 | |
|---|---|---|---|---|
| SCHEMBL22590976 | 0.93 | KDM4E (0.39) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20969329 | 0.91 | PDE4A (0.35) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL19784018 | 0.88 | PDE4A (0.33) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL21220030 | 0.88 | ALOX5AP (0.37) | PDE4AKCNH2GSK3BNTRK1 | |
| SCHEMBL19783488 | 0.88 | ALOX5AP (0.37) | PDE4AKCNH2GSK3BNTRK1 | |
| SCHEMBL19784180 | 0.86 | PDE4A (0.36) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL19784041 | 0.86 | PDE4A (0.34) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL19783491 | 0.85 | KMT2A (0.39) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL20969353 | 0.85 | GSK3B (0.35) | PDE4AKCNH2KDM4EALDH1A1LMNA | |
| SCHEMBL19784014 | 0.85 | GSK3B (0.35) | PDE4AKCNH2KDM4EALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018011017-A1 | 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-01-18 | — | — | WO | disclosed |