Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3979913 | 0.79 | ACHE (0.43) | ACHEKDM4EALDH1A1HPGDGRM2 | |
| SCHEMBL3976388 | 0.76 | HDAC6 (0.32) | ACHEAR | |
| SCHEMBL24036424 | 0.75 | ACHE (0.54) | ACHEKDM4EALDH1A1HPGDGRM2 | |
| SCHEMBL27759034 | 0.73 | ACHE (0.63) | ACHEKDM4EALDH1A1HPGDGRM2 | |
| SCHEMBL12507376 | 0.72 | AR (0.39) | ACHEKDM4EALDH1A1HPGDAR | |
| SCHEMBL3978889 | 0.72 | AR (0.37) | ACHEKDM4EALDH1A1HPGDAR | |
| SCHEMBL2187671 | 0.68 | L3MBTL1 (0.45) | ACHEKDM4EALDH1A1HPGDGRM2 | |
| SCHEMBL25347755 | 0.68 | L3MBTL1 (0.43) | ACHEKDM4EALDH1A1HPGDAR | |
| SCHEMBL24828550 | 0.68 | L3MBTL1 (0.49) | ACHEKDM4EALDH1A1HPGDGRM2 | |
| SCHEMBL2187074 | 0.67 | L3MBTL1 (0.44) | ACHEKDM4EALDH1A1HPGDGRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7541374-B2 | Malononitrile compounds and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-06-02 | — | — | US | disclosed |