Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.30 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28130727 | 0.88 | CHRM1 (0.40) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| SCHEMBL353854 | 0.88 | — | — | |
| SCHEMBL28164277 | 0.85 | TDP1 (0.42) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| Lactic Acid SCHEMBL971160 | 0.75 | TP53 (0.61) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| Cadaverine Tartrate SCHEMBL5874765 | 0.75 | TSHR (0.56) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| Cadaverine Tartrate SCHEMBL5874760 | 0.75 | TSHR (0.56) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| SCHEMBL4756190 | 0.74 | TDP1 (0.50) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| SCHEMBL1604267 | 0.74 | TDP1 (0.50) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| SCHEMBL13761133 | 0.74 | TDP1 (0.50) | CHRM1CHRM3TDP1AKR1A1HTR2A | |
| Ethylmalonate SCHEMBL27739874 | 0.73 | CHRM1 (0.35) | CHRM1CHRM3TDP1AKR1A1HTR2A |
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-107141419-A | A kind of fluorine carbon type aqueous polyurethane acrylate complex emulsions and preparation method | 佛山市三水协佳化工有限公司 | 2017-09-08 | — | — | CN | disclosed |