Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 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 | |
|---|---|---|---|---|
| SCHEMBL577105 | 0.76 | MEN1 (0.41) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL14350785 | 0.73 | MMP2 (0.40) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL576440 | 0.73 | MMP2 (0.40) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL28586518 | 0.72 | MAP3K14 (0.42) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL28593665 | 0.69 | MAP3K14 (0.38) | MAP3K14 | |
| SCHEMBL576431 | 0.69 | MEN1 (0.38) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL3679517 | 0.69 | CYP2C9 (0.35) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL16915056 | 0.69 | MEN1 (0.40) | MEN1CYP2C9KMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL28585360 | 0.68 | MAP3K14 (0.43) | MEN1KMT2AMAP3K14 | |
| SCHEMBL8157678 | 0.68 | TSHR (0.42) | CYP2C9SMN1; SMN2ALDH1A1AKR1C1 |
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-104961712-A | Enantioselective method for synthesizing beta-ester-gamma-butyrolactone | UNIV DALIAN | 2015-10-07 | — | — | CN | disclosed |