Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | VHL | P40337 | 1/20 | 0.39 |
| ▸ | ELOC | Q15369 | 1/20 | 0.39 |
| ▸ | ELOB | Q15370 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | PGK2 | P07205 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19366496 | 0.86 | KEAP1 (0.44) | TSHRBRD4SLC5A2FYNTLR8 | |
| SCHEMBL5106055 | 0.83 | BRD4 (0.53) | TSHRBRD4KCNH2FYNL3MBTL1 | |
| SCHEMBL23578153 | 0.82 | HSP90AB1 (0.46) | BRD4SLC5A2KCNH2 | |
| SCHEMBL29844278 | 0.82 | HSP90AB1 (0.46) | BRD4SLC5A2KCNH2 | |
| SCHEMBL11330543 | 0.78 | KCNH2 (0.62) | BRD4KCNH2L3MBTL1ALDH1A1 | |
| SCHEMBL486201 | 0.75 | CCR1 (0.55) | TSHRKCNH2PGK1PGK2HRH4 | |
| SCHEMBL260498 | 0.74 | TSHR (0.56) | TSHRVHLELOCELOBLTA4H | |
| SCHEMBL11318432 | 0.74 | TSHR (0.56) | TSHRVHLELOCELOBLTA4H | |
| SCHEMBL109053 | 0.72 | CA1 (0.61) | TSHRALDH1A1 | |
| SCHEMBL28111002 | 0.72 | CCR1 (0.52) | TSHRKCNH2PGK1PGK2HRH4 |
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-116199621-A | Synthesis method of chiral pyridine-2, 6-diol | 中国科学院大连化学物理研究所 | 2023-06-02 | — | — | CN | disclosed |