Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.44 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | BAD | Q92934 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | DBH | P09172 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL7035837 | 0.85 | TRIM24 (0.55) | ALDH1A1TRIM24TRIM33MEN1KMT2A | |
| Orthocresol SCHEMBL11055527 | 0.85 | TRPA1 (0.52) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL23093519 | 0.85 | TRPA1 (0.52) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL28051221 | 0.85 | TRPA1 (0.52) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL9063647 | 0.85 | TRPA1 (0.52) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| O-Xylene SCHEMBL18204052 | 0.83 | TRIM24 (0.52) | ALDH1A1TRIM24TRIM33MEN1KMT2A | |
| O-Xylene SCHEMBL3142787 | 0.83 | TSHR (0.53) | ALDH1A1TRIM24TRIM33MEN1KMT2A | |
| Orthocresol SCHEMBL8995948 | 0.80 | — | — | |
| Orthocresol SCHEMBL10419161 | 0.78 | TRPA1 (0.60) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 | |
| Orthocresol SCHEMBL170162 | 0.78 | TRPA1 (0.60) | ALDH1A1TRPA1ATMCYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1333075-A1 | COATING COMPOSITION AND METHOD OF CAN INSIDE COATING | KANSAI PAINT CO., LTD. (JP) | 2003-08-06 | — | — | EP | disclosed |