Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.71 |
| ▸ | TSHR | P16473 | 5/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | SCN1A | P35498 | 2/20 | 0.56 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.56 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5975125 | 0.89 | ALDH1A1 (0.74) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL5975366 | 0.89 | ALDH1A1 (0.74) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL5893357 | 0.88 | TSHR (0.73) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| O-Xylene SCHEMBL27364986 | 0.87 | ALDH1A1 (0.87) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Biphenyl SCHEMBL27403396 | 0.87 | ALDH1A1 (0.87) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL27489710 | 0.87 | ALDH1A1 (0.71) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL9585464 | 0.86 | TSHR (0.78) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Biphenyl SCHEMBL27825353 | 0.86 | ALDH1A1 (0.84) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Biphenyl SCHEMBL28278261 | 0.86 | ALDH1A1 (0.84) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Tannin Pyrogallol SCHEMBL28166689 | 0.86 | ALDH1A1 (0.84) | ALDH1A1TSHRLMNACYP3A4MAPK1 |
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-101189207-B | A process to produce an enriched composition through the use of a catalyst removal zone and an enrichment zone | EASTMAN CHEM CO | 2012-11-14 | — | — | CN | disclosed |
| CN-101189207-A | A process to produce an enriched composition through the use of a catalyst removal zone and an enrichment zone | EASTMAN CHEM CO (US) | 2008-05-28 | — | — | CN | disclosed |