Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MME | P08473 | 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 | |
|---|---|---|---|---|
| SCHEMBL28037867 | 0.89 | GAA (0.51) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL28037870 | 0.83 | GAA (0.50) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL28037625 | 0.73 | GAA (0.45) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL28037869 | 0.72 | GAA (0.44) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL13938473 | 0.69 | NPC1 (0.46) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL5201218 | 0.69 | SMYD3 (0.44) | GAARECQLRAB9ANPC1SMYD3 | |
| SCHEMBL15131361 | 0.69 | ALDH1A1 (0.48) | GAARAB9ANPC1MAPTL3MBTL1 | |
| SCHEMBL19701378 | 0.63 | SMYD3 (0.70) | RAB9ANPC1SMYD3MAPTL3MBTL1 | |
| SCHEMBL15131400 | 0.61 | ALDH1A1 (0.45) | GAAMAPTL3MBTL1KMT2AALDH1A1 | |
| SCHEMBL23907305 | 0.60 | ALDH1A1 (0.48) | GAARAB9ANPC1MAPTL3MBTL1 |
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 |