Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 4/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29249169 | 0.89 | FAAH (0.47) | SMN1; SMN2FAAHGPR84FFAR1ALDH1A1 | |
| SCHEMBL2229574 | 0.85 | SMN1; SMN2 (0.43) | SMN1; SMN2GPR84SLC22A6ALDH1A1 | |
| SCHEMBL2231280 | 0.80 | PRKCA (0.40) | SMN1; SMN2GPR84CHRM1AKR1A1CHRM3 | |
| SCHEMBL26073636 | 0.79 | SMN1; SMN2 (0.38) | SMN1; SMN2CHRM1TDP1SLC22A6ALDH1A1 | |
| SCHEMBL19359076 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2GPR84ADRA1ATDP1SLC22A6 | |
| SCHEMBL305577 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2GPR84ADRA1ATDP1SLC22A6 | |
| SCHEMBL5586418 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2GPR84ADRA1ATDP1SLC22A6 | |
| SCHEMBL4530794 | 0.78 | FAAH (0.44) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL31289248 | 0.78 | SMN1; SMN2 (0.48) | SMN1; SMN2GPR84ADRA1ATDP1SLC22A6 | |
| SCHEMBL1242013 | 0.77 | GPR84 (0.43) | SMN1; SMN2GPR84FFAR1 |
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-111201321-B | Genetically modified isopropyl malate isomerase enzyme complex and preparation of elongated 2-keto acids and C using same5-C10Method for preparing compounds | 陶氏环球技术有限责任公司 | 2024-07-12 | — | — | CN | disclosed |