Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL416276 | 0.83 | CYP2C19 (0.50) | CYP2D6TSHRCYP2C19HIF1AHMGCR | |
| SCHEMBL3713463 | 0.83 | CYP2C19 (0.50) | CYP2D6TSHRCYP2C19HIF1AHMGCR | |
| SCHEMBL4628158 | 0.83 | CYP2C19 (0.50) | CYP2D6TSHRCYP2C19HIF1AHMGCR | |
| Pivalate SCHEMBL9055894 | 0.77 | TDP1 (0.35) | CYP2D6TSHRCYP2C19HIF1A | |
| Citric Acid SCHEMBL411716 | 0.74 | ALDH1A1 (0.60) | CYP2D6TSHRCYP2C19HIF1AHMGCR | |
| Citric Acid SCHEMBL27874691 | 0.74 | ALDH1A1 (0.54) | CYP2D6TSHRCYP2C19HIF1AHMGCR | |
| SCHEMBL3348790 | 0.74 | ALDH1A1 (0.37) | CYP2D6TSHRCYP2C19HIF1A | |
| Propionic Acid SCHEMBL3430108 | 0.71 | FFAR3 (0.50) | CYP2D6TSHR | |
| SCHEMBL782367 | 0.71 | TSHR (0.37) | CYP2D6TSHRCYP2C19HIF1A | |
| Citric Acid SCHEMBL28485608 | 0.70 | ALDH1A1 (0.54) | CYP2D6TSHRHMGCRCHRM1TBXA2R |
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-104558422-B | Method for preparing thermoplastic cellulose based copolymer | 天津工业大学 | 2017-02-22 | — | — | CN | disclosed |