Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | RARA | P10276 | 2/20 | 0.42 |
| ▸ | RARB | P10826 | 2/20 | 0.42 |
| ▸ | RARG | P13631 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2222005 | 0.87 | ALDH1A1 (0.50) | ALDH1A1TDP1GLAPOLBL3MBTL1 | |
| SCHEMBL28085120 | 0.83 | ALDH1A1 (0.41) | ALDH1A1TDP1GLAPOLBL3MBTL1 | |
| SCHEMBL1304100 | 0.76 | CYP2A6 (0.38) | ALDH1A1POLBKMT2ACA1HPGD | |
| SCHEMBL8580744 | 0.74 | ALDH1A1 (0.68) | ALDH1A1TDP1GLAPOLBL3MBTL1 | |
| Terephthalic Acid SCHEMBL2687529 | 0.72 | TSHR (0.63) | ALDH1A1TSHRTP53SRD5A2CA1 | |
| Terephthalic Acid SCHEMBL11490240 | 0.72 | TSHR (0.63) | ALDH1A1TSHRTP53SRD5A2CA1 | |
| Terephthalic Acid SCHEMBL8506032 | 0.72 | TSHR (0.63) | ALDH1A1TSHRTP53SRD5A2CA1 | |
| SCHEMBL17685853 | 0.72 | ALDH1A1 (0.52) | ALDH1A1TSHRTP53LMNAHPGD | |
| Ethylene Glycol SCHEMBL10660552 | 0.71 | ALDH1A1 (0.58) | ALDH1A1TDP1GLAPOLBL3MBTL1 | |
| Terephthalic Acid SCHEMBL10952725 | 0.71 | ALDH1A1 (0.58) | ALDH1A1TDP1GLAPOLBL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102712787-B | Based on acetal compound for polyolefinic nucleator | 瑞来斯实业公司 | 2016-08-17 | — | — | CN | claimed |
| CN-102712787-B | Based on acetal compound for polyolefinic nucleator | 瑞来斯实业公司 | 2016-08-17 | — | — | CN | disclosed |