Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 2/20 | 0.46 |
| ▸ | CHAT | P28329 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28897308 | 1.00 | FBP1 (0.46) | FBP1CHATCHRM5RELAAKR1C3 | |
| SCHEMBL19677096 | 0.80 | FBP1 (0.47) | FBP1CHATCHRM5RELAAKR1C3 | |
| SCHEMBL28444098 | 0.79 | ALDH1A1 (0.46) | AKR1C3AKR1C2KMT2AALDH1A1POLB | |
| SCHEMBL28444099 | 0.79 | ALDH1A1 (0.46) | AKR1C3AKR1C2KMT2AALDH1A1POLB | |
| SCHEMBL28441890 | 0.77 | AKR1C3 (0.46) | FBP1AKR1C3CYP1A2CYP2C9AKR1C2 | |
| SCHEMBL28441324 | 0.77 | AKR1C3 (0.43) | FBP1AKR1C3AKR1C2AKR1C1KMT2A | |
| SCHEMBL28441323 | 0.77 | AKR1C3 (0.43) | FBP1AKR1C3AKR1C2AKR1C1KMT2A | |
| SCHEMBL14198038 | 0.75 | FBP1 (0.53) | FBP1CHATCHRM5RELAAKR1C3 | |
| SCHEMBL31370920 | 0.72 | FBP1 (0.50) | FBP1CHATCHRM5RELAAKR1C3 | |
| SCHEMBL28441889 | 0.71 | RELA (0.48) | RELAAKR1C3KDM4EALDH1A1GRIN2D |
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-111559971-A | Method for constructing iodoalkenyl thioether from olefin, iodine and dimethyl sulfoxide | 沅江华龙催化科技有限公司 | 2020-08-21 | — | — | CN | disclosed |