Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23291424 | 1.00 | CYP2A6 (0.31) | CYP2A6ALDH1A1TSHRHSD17B10CYP1A1 | |
| SCHEMBL15517841 | 0.83 | AHR (0.36) | TSHR | |
| SCHEMBL29962329 | 0.78 | TSHR (0.39) | CYP2A6ALDH1A1TSHRHSD17B10CYP1A1 | |
| SCHEMBL9512355 | 0.78 | TSHR (0.39) | CYP2A6ALDH1A1TSHRHSD17B10CYP1A1 | |
| SCHEMBL30702232 | 0.73 | CYP2A6 (0.32) | CYP2A6ALDH1A1 | |
| SCHEMBL29106961 | 0.73 | CYP2A6 (0.32) | CYP2A6ALDH1A1 | |
| SCHEMBL15521481 | 0.71 | ALDH1A1 (0.32) | ALDH1A1CYP3A4HPGDMEN1KMT2A | |
| SCHEMBL15521412 | 0.71 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL15521502 | 0.68 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL15521010 | 0.65 | TYMS (0.38) | ALDH1A1HPGDMEN1KMT2A |
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-111333617-B | Fluorescent dye for lipid drop labeling and synthetic method and application thereof | 中国科学院大连化学物理研究所 | 2022-06-03 | — | — | CN | claimed |