Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Orthocresol SCHEMBL7651591 | 0.84 | TRPA1 (0.43) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Catechol SCHEMBL10692999 | 0.83 | ALDH1A1 (0.59) | CYP1A2CYP2C19ALDH1A1MAPTLMNA | |
| SCHEMBL29102551 | 0.83 | TRPA1 (0.71) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Orthocresol SCHEMBL29395276 | 0.83 | — | — | |
| Orthocresol SCHEMBL8710164 | 0.83 | TRPA1 (0.60) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Orthocresol SCHEMBL170162 | 0.83 | TRPA1 (0.60) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Orthocresol SCHEMBL10419161 | 0.83 | TRPA1 (0.60) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Orthocresol SCHEMBL16002 | 0.83 | — | — | |
| Orthocresol SCHEMBL10534073 | 0.81 | TRPA1 (0.48) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 | |
| Orthocresol SCHEMBL5498033 | 0.81 | TRPA1 (0.48) | TRPA1ATMCYP1A2CYP2C19ALDH1A1 |
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-111403607-A | Chelated perovskite material, film, device and preparation method and application thereof | 华东理工大学 | 2020-07-10 | — | — | CN | disclosed |