Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.74 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | CA3 | P07451 | 1/20 | 0.58 |
| ▸ | CA4 | P22748 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| Phenol SCHEMBL541839 | 1.00 | ALDH1A1 (0.74) | ALDH1A1CA12CA2CA9CA14 | |
| Phenol SCHEMBL28898266 | 0.93 | ALDH1A1 (0.64) | ALDH1A1CA12CA2CA9CA14 | |
| Orthocresol SCHEMBL9805651 | 0.91 | ALDH1A1 (0.61) | ALDH1A1CA12CA2CA9CA14 | |
| Orthocresol SCHEMBL11149192 | 0.91 | ALDH1A1 (0.61) | ALDH1A1CA12CA2CA9CA14 | |
| Phenol SCHEMBL4409068 | 0.88 | TRPA1 (0.77) | ALDH1A1CA12CA2CA9CA14 | |
| O-Xylene SCHEMBL467845 | 0.86 | CA12 (0.69) | ALDH1A1CA12CA2CA9CA14 | |
| SCHEMBL11575272 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CA2CA9CA1TDP1 | |
| SCHEMBL64141 | 0.86 | — | — | |
| SCHEMBL2500374 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CA2CA9CA1TDP1 | |
| Resorcinol SCHEMBL357511 | 0.84 | ALDH1A1 (0.74) | ALDH1A1CA12CA2CA9CA14 |
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-1036815-A1 | FLAME RETARDANT FOR STYRENE RESINS AND FLAME-RETARDANT STYRENE RESIN COMPOSITION | CHISSO CORPORATION (JP) | 2000-09-20 | — | — | EP | disclosed |