Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 9/20 | 0.45 |
| ▸ | CES1 | P23141 | 4/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9175531 | 0.91 | CES2 (0.44) | CES2CES1AKR1B1FAAHHSP90AA1 | |
| Butyl Alcohol SCHEMBL309122 | 0.89 | ALDH1A1 (0.48) | CES2CES1ALDH1A1TSHR | |
| SCHEMBL28494 | 0.87 | — | — | |
| SCHEMBL1536952 | 0.87 | HMGCR (0.43) | ALDH1A1TSHRTDP1 | |
| Alcohol SCHEMBL8063388 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TSHRTDP1 | |
| Butanone SCHEMBL1445496 | 0.84 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1 | |
| Acetone SCHEMBL2784800 | 0.84 | HMGCR (0.41) | ALDH1A1TSHRTDP1 | |
| Hydrogen Peroxide SCHEMBL11424917 | 0.84 | HMGCR (0.48) | ALDH1A1TSHRTDP1 | |
| Ammonia Solution, Strong SCHEMBL9790221 | 0.84 | — | — | |
| SCHEMBL8482096 | 0.84 | — | — |
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-109952535-A | Colored photosensitive resin composition, pigment dispersion, partition wall, organic electroluminescent element, image display device, and illumination | 三菱化学株式会社 | 2019-06-28 | — | — | CN | disclosed |