Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALB | P02768 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31177366 | 0.81 | TLR9 (0.43) | TLR9MCHR1ALDH1A1CYP2C9TDP1 | |
| SCHEMBL8472264 | 0.79 | TLR9 (0.42) | TLR9MCHR1ALDH1A1CYP2C9TDP1 | |
| SCHEMBL28431666 | 0.74 | TSHR (0.48) | TSHRRAB9ACA1CA2NPC1 | |
| SCHEMBL28552414 | 0.73 | CNR2 (0.47) | TLR9CYP2C9LMNATSHRRAB9A | |
| SCHEMBL7878733 | 0.72 | TLR9 (0.52) | TLR9MCHR1ALDH1A1CYP2C9TDP1 | |
| SCHEMBL28268588 | 0.72 | TLR9 (0.55) | TLR9ALDH1A1CYP2C9TDP1RAB9A | |
| SCHEMBL29253907 | 0.71 | MCHR1 (0.42) | TLR9MCHR1ALDH1A1CYP2C9TDP1 | |
| SCHEMBL8655900 | 0.71 | TLR9 (0.50) | TLR9MCHR1ALDH1A1CYP2C9TDP1 | |
| Hexane SCHEMBL7122950 | 0.71 | MCHR1 (0.53) | MCHR1ALDH1A1CYP2C9TDP1LMNA | |
| SCHEMBL7985352 | 0.71 | TLR9 (0.46) | TLR9ALDH1A1CYP2C9TDP1LMNA |
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-108997178-B | Synthesis method of β -iodoalkenylsulfone compound | 湖南文理学院 | 2020-07-31 | — | — | CN | disclosed |