Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | DBH | P09172 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19805979 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ENPC1TP53TSHR | |
| SCHEMBL19805921 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KDM4EMITFHTTMEP1B | |
| SCHEMBL19805909 | 0.76 | ALDH1A1 (0.56) | ALDH1A1KDM4EHTTSMN1; SMN2PPARG | |
| SCHEMBL8327653 | 0.72 | ALDH1A1 (0.59) | ALDH1A1KDM4EMITFHTTMEP1B | |
| SCHEMBL8324389 | 0.72 | HTR7 (0.58) | ALDH1A1KDM4EMITFHTTMEP1B | |
| SCHEMBL8481621 | 0.70 | ALDH1A1 (0.71) | ALDH1A1KDM4EHTTNPC1TP53 | |
| SCHEMBL21019815 | 0.70 | KDM4E (0.35) | ALDH1A1KDM4EMITFHTTMEP1B | |
| SCHEMBL2759522 | 0.69 | HTT (0.51) | ALDH1A1KDM4EMITFHTTNPC1 | |
| SCHEMBL3436226 | 0.69 | HTT (0.52) | ALDH1A1KDM4EMITFHTTMEP1B | |
| SCHEMBL14340525 | 0.69 | KDM4E (0.52) | ALDH1A1KDM4EMITFHTTSMN1; SMN2 |
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-3484854-B1 | APOPTOSIS INHIBITORS | NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) | 2021-01-20 | — | — | EP | disclosed |