Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SLC13A5 | Q86YT5 | 7/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL425246 | 0.92 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL28501142 | 0.88 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL536764 | 0.87 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL24971050 | 0.87 | ALDH1A1 (0.42) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL28488194 | 0.85 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL2829363 | 0.85 | ALDH1A1 (0.54) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL28495434 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL28706880 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL15512778 | 0.84 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTLMNATSHR | |
| SCHEMBL489813 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTLMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-112041383-A | Plasticizer composition and resin composition comprising the same | 株式会社LG化学 | 2020-12-04 | — | — | CN | disclosed |