Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.41 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 3/20 | 0.35 |
| ▸ | TPMT | P51580 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| Iodobenzene SCHEMBL2485086 | 0.88 | CES1 (0.50) | CES1CPA1FAAHTPMTTRPV1 | |
| Iodobenzene SCHEMBL334303 | 0.88 | CES1 (0.50) | CES1CPA1FAAHTPMTTRPV1 | |
| Iodobenzene SCHEMBL2237441 | 0.88 | CES1 (0.50) | CES1CPA1FAAHTPMTTRPV1 | |
| Iodobenzene SCHEMBL15140156 | 0.82 | CES1 (0.45) | CES1CPA1TPMTSMN1; SMN2TRPV1 | |
| Trifluoroacetic Acid SCHEMBL8593342 | 0.78 | ACLY (0.39) | CES1SMN1; SMN2 | |
| Iodobenzene SCHEMBL27524285 | 0.77 | CES1 (0.54) | CES1CPA1FAAHTPMTTRPV1 | |
| Iodobenzene SCHEMBL28291735 | 0.77 | CES1 (0.41) | CES1CPA1TPMTSMN1; SMN2HIF1A | |
| Iodobenzene SCHEMBL27483365 | 0.74 | AKR1B1 (0.42) | CES1TPMTSMN1; SMN2SLC6A3HDAC1 | |
| Benzene SCHEMBL26127054 | 0.73 | CES1 (0.36) | CES1 | |
| Iodobenzene SCHEMBL31181901 | 0.72 | CYP2C19 (0.44) | CES1TPMTHIF1AKIF11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105017124-A | Novel method for synthesizing clausenamide | UNIV GUANGXI NORMAL | 2015-11-04 | — | — | CN | claimed |
| CN-105017124-A | Novel method for synthesizing clausenamide | UNIV GUANGXI NORMAL | 2015-11-04 | — | — | CN | disclosed |