Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2662008 | 0.81 | TMEM97 (0.45) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL1080225 | 0.81 | TMEM97 (0.45) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL1065369 | 0.77 | TMEM97 (0.42) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL1065374 | 0.77 | TMEM97 (0.42) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL1059613 | 0.76 | ALDH1A1 (0.41) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL610404 | 0.76 | ALDH1A1 (0.41) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL610403 | 0.76 | ALDH1A1 (0.41) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL15846862 | 0.75 | MAPK14 (0.46) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL15846861 | 0.75 | MAPK14 (0.46) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 | |
| SCHEMBL12200438 | 0.75 | ALDH1A1 (0.45) | TMEM97SIGMAR1ALDH1A1NPSR1MAPK14 |
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-2268633-A1 | PYRIDAZINONE GLUCOKINASE ACTIVATORS | F. Hoffmann-La Roche AG (CH) | 2011-01-05 | — | — | EP | disclosed |