Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4655991 | 0.81 | LOXL2 (0.46) | KCNH2ALDH1A1LOXL2CYP2C19TSHR | |
| SCHEMBL4657431 | 0.80 | CYP2C19 (0.42) | KCNH2ALDH1A1LOXL2CYP2C19TSHR | |
| SCHEMBL6918166 | 0.78 | PSMD14 (0.40) | ALDH1A1MAPTKMT2ALMNAHTT | |
| SCHEMBL6921008 | 0.76 | KMT2A (0.42) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL6839983 | 0.75 | LOXL2 (0.42) | KCNH2ALDH1A1MAPTLOXL2CYP2C19 | |
| SCHEMBL6920878 | 0.75 | CA1 (0.37) | ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL6835187 | 0.75 | ESR1 (0.36) | MEN1KMT2ALMNAHTTSMN1; SMN2 | |
| SCHEMBL6921574 | 0.72 | MCL1 (0.33) | KCNH2TSHR | |
| SCHEMBL6821404 | 0.72 | TSHR (0.40) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL680595 | 0.72 | KCNH2 (0.74) | KCNH2ALDH1A1MAPTLOXL2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1385377-A1 | PESTICIDE COMPOSITION COMPRISING MALONONITRILE COMPOUNDS | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 2004-02-04 | — | — | EP | disclosed |
| WO-2002089579-A1 | PESTICIDE COMPOSITION COMPRISING MALONONITRILE COMPOUNDS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-11-14 | — | — | WO | disclosed |