Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | PTPRC | P08575 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | FGR | P09769 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.41 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL79135 | 0.74 | BRD4 (0.43) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| SCHEMBL855431 | 0.72 | MAOA (0.56) | HSD17B10PTPRCMAOAPARP1CASP1 | |
| SCHEMBL29385474 | 0.72 | MAOA (0.56) | HSD17B10PTPRCMAOAPARP1CASP1 | |
| SCHEMBL2480404 | 0.71 | PARP1 (0.56) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| SCHEMBL169281 | 0.71 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| SCHEMBL31607672 | 0.71 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| SCHEMBL8993649 | 0.70 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| Water SCHEMBL460840 | 0.69 | MAOA (0.54) | HSD17B10PTPRCMAOAPARP1CASP1 | |
| SCHEMBL4939029 | 0.68 | ALDH1A1 (0.93) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC | |
| Hydrochloric Acid SCHEMBL21465353 | 0.68 | ALDH1A1 (0.93) | ALDH1A1L3MBTL1HSD17B10ADORA2APTPRC |
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 |
|---|---|---|---|---|---|---|---|
| EP-0761673-A1 | Cephalosporin derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1997-03-12 | — | — | EP | claimed |