Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ARG1 | P05089 | 1/20 | 0.31 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5325425 | 0.85 | CYP2C19 (0.45) | CYP2C19TBXAS1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL6627748 | 0.79 | GLA (0.49) | CYP2C19CYP1A2SMN1; SMN2GLAALDH1A1 | |
| SCHEMBL5327581 | 0.76 | HRH1 (0.44) | CYP2C19HRH1 | |
| SCHEMBL7620722 | 0.76 | SIGMAR1 (0.51) | SMN1; SMN2ALDH1A1POLBHTR7 | |
| SCHEMBL6223421 | 0.72 | HRH1 (0.43) | CYP1A2SMN1; SMN2HRH1ALDH1A1PAOX | |
| SCHEMBL25011375 | 0.71 | CYP2C19 (0.36) | CYP2C19TBXAS1CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL798204 | 0.70 | TBXAS1 (0.45) | CYP2C19TBXAS1 | |
| SCHEMBL18549878 | 0.70 | — | — | |
| SCHEMBL798344 | 0.70 | TBXAS1 (0.45) | CYP2C19TBXAS1 | |
| SCHEMBL797992 | 0.70 | TBXAS1 (0.45) | CYP2C19TBXAS1 |
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-2007142804-A2 | PREPARATION OF COMPLEXING AGENTS AND METAL ION COMPLEXES IN AQUEOUS MEDIA | MALLINCKRODT INC. (US) | 2007-12-13 | — | — | WO | disclosed |