Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28840375 | 0.94 | LMNA (0.46) | LMNAHDAC4PPARGPPARAKAT6A | |
| SCHEMBL15524867 | 0.79 | MYC (0.45) | LMNAELANEKDM4EALDH1A1MAPK1 | |
| Bicarbonate SCHEMBL10672835 | 0.77 | NOTUM (0.57) | LMNAHDAC4KAT6ANOTUMKDM4E | |
| SCHEMBL27312206 | 0.77 | TSHR (0.53) | LMNAKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL27605945 | 0.75 | LMNA (0.47) | LMNAHDAC4KAT6AELANEALDH1A1 | |
| SCHEMBL27250 | 0.73 | NOTUM (0.65) | LMNAHDAC4KAT6ANOTUMKDM4E | |
| SCHEMBL27584512 | 0.73 | LMNA (0.48) | LMNAHDAC4KAT6ANOTUMKDM4E | |
| SCHEMBL28803951 | 0.73 | LMNA (0.42) | LMNAHDAC4KAT6AELANENOTUM | |
| SCHEMBL1586230 | 0.73 | ELANE (0.49) | LMNAKAT6AELANEKDM4EALDH1A1 | |
| Methylamine SCHEMBL27947262 | 0.72 | NOTUM (0.59) | LMNAHDAC4KAT6ANOTUMKDM4E |
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-103833744-B | 1 ethyl pyrazolyl acrylonitrile compound and application thereof | 沈阳中化农药化工研发有限公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-103833668-B | O-trifluoromethyl phenylpropen nitrile compounds and application thereof | 沈阳中化农药化工研发有限公司 | 2016-08-03 | — | — | CN | disclosed |