Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PTGER1 | P34995 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2108801 | 0.83 | CYP1A2 (0.72) | ALDH1A1CYP1A2TSHRL3MBTL1MAPT | |
| SCHEMBL12454294 | 0.82 | MAPT (0.56) | ALDH1A1CYP1A2L3MBTL1MAPTKMT2A | |
| SCHEMBL14825253 | 0.81 | CYP1A2 (0.54) | ALDH1A1CYP1A2TSHRL3MBTL1MAPT | |
| SCHEMBL29810272 | 0.80 | MAPT (0.51) | CYP1A2MAPTGAATP53BRD4 | |
| SCHEMBL1181244 | 0.80 | MAPT (0.51) | CYP1A2MAPTGAATP53BRD4 | |
| SCHEMBL6213581 | 0.77 | CYP3A4 (0.49) | ALDH1A1CYP1A2TSHRL3MBTL1MAPT | |
| SCHEMBL2352200 | 0.76 | CYP1A2 (0.44) | ALDH1A1CYP1A2L3MBTL1MAPTKMT2A | |
| SCHEMBL29844105 | 0.76 | CYP1A2 (0.44) | ALDH1A1CYP1A2L3MBTL1MAPTKMT2A | |
| SCHEMBL22012729 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CYP1A2TSHRL3MBTL1MAPT | |
| SCHEMBL4859332 | 0.74 | NPSR1 (0.43) | ALDH1A1CYP1A2TSHRLMNANPSR1 |
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-2536691-B1 | BIFUNCTIONAL CHELATING AGENTS | Nordion (Canada) Inc (CA) | 2017-11-22 | — | — | EP | disclosed |