Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL28349524 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4ESMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL28350046 | 0.82 | KDM4E (0.41) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL28882198 | 0.82 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2LMNAMAPK1 | |
| SCHEMBL28350119 | 0.82 | PTGS2 (0.45) | ALDH1A1KDM4ESMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL28346751 | 0.81 | ALDH1A1 (0.60) | ALDH1A1KDM4ESMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL28350054 | 0.79 | GRM2 (0.47) | ALDH1A1KDM4ESMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL28346775 | 0.78 | KIF11 (0.47) | ALDH1A1KDM4ESMN1; SMN2MAPTCYP11B2 | |
| SCHEMBL28346773 | 0.76 | ALDH1A1 (0.40) | ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1 | |
| SCHEMBL28346865 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KDM4ESMN1; SMN2MAPTTSHR | |
| SCHEMBL26830920 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110746336-B | Green preparation method of N-methyl-2-cyano-3-arylpyrrole compound | 湖南科技学院 | 2021-05-07 | — | — | CN | disclosed |
| CN-110759846-B | Method for synthesizing polysubstituted azole compound by using olefin in one pot | 湖南科技学院 | 2021-05-07 | — | — | CN | disclosed |
| CN-110759846-A | Method for synthesizing polysubstituted azole compound by using olefin in one pot | 湖南科技学院 | 2020-02-07 | — | — | CN | disclosed |
| CN-110746336-A | Green preparation method of N-methyl-2-cyano-3-arylpyrrole compound | 湖南科技学院 | 2020-02-04 | — | — | CN | disclosed |