Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.51 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.48 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7768531 | 0.85 | PKM (0.58) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL9741323 | 0.85 | PLA2G4B (0.71) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL8652183 | 0.81 | LMNA (0.63) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL7768982 | 0.81 | PLA2G4B (0.55) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL9741504 | 0.81 | PLA2G4B (0.55) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL24198673 | 0.80 | PLA2G4B (0.61) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL17908021 | 0.80 | PLA2G4B (0.61) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL17908101 | 0.80 | PLA2G4B (0.61) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL4366529 | 0.79 | PKM (0.56) | PLA2G4BPKMMAPK1POLBNR4A2 | |
| SCHEMBL834902 | 0.79 | NR1H4 (0.70) | PLA2G4BPKMMAPK1POLBNR4A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5871709-A | TETRAAZACYCLODODECANE COMPOUNDS SUBSTITUTED WITH ALKYL CARBOXY COMPOUNDS FOR CARDIOVASCULAR DISORDERS AND BRAIN TUMORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-02-16 | — | — | US | claimed |