Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CCR3 | P51677 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 3/20 | 0.33 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21709180 | 0.81 | CDK8 (0.41) | KDM4EALDH1A1PPARAPPARGPPARD | |
| SCHEMBL21709167 | 0.76 | TDP1 (0.39) | KDM4EALDH1A1SMN1; SMN2NFKB1LMNA | |
| SCHEMBL21709181 | 0.74 | LMNA (0.41) | KDM4EALDH1A1CCR3ACHEPPARA | |
| SCHEMBL21709170 | 0.73 | AOC3 (0.33) | — | |
| SCHEMBL21709166 | 0.67 | APP (0.38) | KDM4EALOX5NFKB1 | |
| SCHEMBL31376296 | 0.65 | PPARG (0.53) | KDM4EALDH1A1CCR3ACHEPPARA | |
| SCHEMBL27983620 | 0.65 | PPARG (0.53) | KDM4EALDH1A1CCR3ACHEPPARA | |
| SCHEMBL27983345 | 0.65 | PPARG (0.53) | KDM4EALDH1A1CCR3ACHEPPARA | |
| SCHEMBL27983181 | 0.65 | PPARG (0.53) | KDM4EALDH1A1CCR3ACHEPPARA | |
| SCHEMBL21709177 | 0.65 | ALOX15 (0.31) | — |
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-2020032080-A1 | COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND | 学校法人慶應義塾 | 2020-02-13 | — | — | WO | disclosed |