Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.56 |
| ▸ | MAPT | P10636 | 11/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.56 |
| ▸ | RELA | Q04206 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | GLA | P06280 | 6/20 | 0.45 |
| ▸ | ATM | Q13315 | 6/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | CASP1 | P29466 | 4/20 | 0.43 |
| ▸ | CASP7 | P55210 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28037536 | 0.89 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTNFKB1NFKB2 | |
| SCHEMBL28823297 | 0.87 | MAPT (0.51) | ALDH1A1KDM4EMAPTNFKB1NFKB2 | |
| SCHEMBL28037530 | 0.85 | TOP2A (0.47) | ALDH1A1KDM4EMAPTNFKB1NFKB2 | |
| SCHEMBL29952780 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL6965148 | 0.71 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL28473974 | 0.69 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL15178535 | 0.69 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL28037538 | 0.68 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL6982766 | 0.68 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTNPSR1MEN1 | |
| SCHEMBL21456977 | 0.67 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTNPSR1MEN1 |
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-105017197-A | Semicarbazone compound preparation method and application in biomedicine | UNIV HUAZHONG NORMAL | 2015-11-04 | — | — | CN | disclosed |