Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | TNF | P01375 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8355373 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL8355366 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL9155153 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL9115691 | 0.77 | TNF (0.58) | ALDH1A1TNFACHEPOLBPPARG | |
| SCHEMBL3451872 | 0.76 | ACHE (0.55) | ALDH1A1TNFACHEPOLBPPARG | |
| SCHEMBL497761 | 0.76 | SMN1; SMN2 (0.52) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL6938995 | 0.74 | REN (0.44) | TNFACHEPOLBCYP2C19CYP1A2 | |
| SCHEMBL8771284 | 0.74 | ACHE (0.56) | TNFACHEPOLBPPARGPPARD | |
| SCHEMBL27463508 | 0.73 | FFAR1 (0.46) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL4671897 | 0.73 | ACHE (0.59) | ALDH1A1TNFACHEPOLBPPARG |
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-5859279-A | Compound and process | DARWIN DISCOVERY LIMITED (GB) | 1999-01-12 | — | — | US | disclosed |