Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 2/20 | 0.42 |
| ▸ | CTSK | P43235 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 7/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | HTT | P42858 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | XBP1 | P17861 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | PKM | P14618 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 3/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1705902 | 0.85 | CXCR2 (0.48) | CXCR2CTSKALDH1A1LMNANPSR1 | |
| SCHEMBL29465735 | 0.77 | CTSK (0.52) | CTSKATMMAPT | |
| SCHEMBL5460811 | 0.77 | CTSK (0.52) | CTSKATMMAPT | |
| SCHEMBL1784108 | 0.77 | CTSK (0.52) | CTSKATMMAPT | |
| SCHEMBL717324 | 0.77 | CTSK (0.52) | CTSKATMMAPT | |
| SCHEMBL3372679 | 0.75 | AAK1 (0.43) | CTSKALDH1A1ATMLMNANPSR1 | |
| SCHEMBL29955950 | 0.75 | PPARG (0.44) | CTSKALDH1A1ATMLMNATSHR | |
| SCHEMBL3378239 | 0.75 | CTSK (0.46) | CTSKALDH1A1ATMLMNANPSR1 | |
| SCHEMBL29952714 | 0.75 | PPARG (0.44) | CTSKALDH1A1ATMLMNATSHR | |
| SCHEMBL27674504 | 0.75 | CTSK (0.46) | CTSKALDH1A1ATMLMNANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012000608-A2 | NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES | GLUESENKAMP KARL-HEINZ (DE) | 2012-01-05 | — | — | WO | disclosed |