Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.47 |
| ▸ | CTSS | P25774 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14908706 | 1.00 | CTSK (0.47) | CTSKCTSSKMT2AMEN1THRB | |
| SCHEMBL3760185 | 1.00 | CTSK (0.47) | CTSKCTSSKMT2AMEN1THRB | |
| SCHEMBL30109123 | 0.92 | CTSS (0.41) | CTSKCTSSKMT2AMEN1AKT1 | |
| SCHEMBL34471389 | 0.91 | ALDH1A1 (0.46) | CTSKCTSSKMT2AAKT1MAPT | |
| SCHEMBL30109136 | 0.89 | POLB (0.48) | KMT2AMEN1MAPTATMALDH1A1 | |
| SCHEMBL30109325 | 0.89 | POLB (0.48) | KMT2AMEN1MAPTATMALDH1A1 | |
| SCHEMBL5576694 | 0.89 | KMT2A (0.43) | CTSKCTSSKMT2AMEN1THRB | |
| SCHEMBL10324475 | 0.88 | HDAC7 (0.46) | CTSKCTSSKMT2AAKT1MAPT | |
| SCHEMBL10324476 | 0.88 | HDAC7 (0.46) | CTSKCTSSKMT2AAKT1MAPT | |
| SCHEMBL23017648 | 0.88 | KMT2A (0.43) | KMT2AMEN1MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102958918-A | Novel nicotinamide derivatives or salts thereof | FUJIFILM CORP | 2013-03-06 | — | — | CN | disclosed |
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |