Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | NAAA | Q02083 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 5/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hexyl Acetate SCHEMBL5885091 | 0.96 | ALDH1A1 (0.63) | ALDH1A1NAAATSHREPHX1CES2 | |
| Acetic Acid Butyl Ester SCHEMBL27663808 | 0.94 | ALDH1A1 (0.78) | ALDH1A1NAAATSHREPHX1CES2 | |
| Acetic Acid Butyl Ester SCHEMBL11120658 | 0.91 | ALDH1A1 (0.82) | ALDH1A1NAAATSHREPHX1HCAR2 | |
| SCHEMBL12818093 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| Octyl Acetate SCHEMBL4344544 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| Dodecylacetate SCHEMBL159219 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| SCHEMBL131668 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| Tridecylacetate SCHEMBL157239 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| Nonylacetate SCHEMBL309051 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 | |
| Nonylacetate SCHEMBL10804375 | 0.91 | ALDH1A1 (0.81) | ALDH1A1NAAATSHREPHX1CES2 |
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-107880871-A | Quantum dot dispersion liquid, self-luminous photosensitive polymer combination and application thereof | 东友精细化工有限公司 | 2018-04-06 | — | — | CN | disclosed |