Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | MELK | Q14680 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8028359 | 0.73 | SMN1; SMN2 (0.35) | ALDH1A1MAPTKDM4EGAATAS1R3 | |
| SCHEMBL8035126 | 0.68 | ALDH1A1 (0.40) | ALDH1A1MAPTKDM4EGAAERN1 | |
| SCHEMBL12082469 | 0.67 | COMT (0.42) | ALDH1A1MAPTKDM4EPOLBLMNA | |
| SCHEMBL12082492 | 0.67 | SMN1; SMN2 (0.46) | ALDH1A1MAPTKDM4EGAAERN1 | |
| SCHEMBL12082409 | 0.66 | EGFR (0.37) | ALDH1A1MAPTKDM4EERN1POLB | |
| SCHEMBL12082329 | 0.65 | EGFR (0.37) | ALDH1A1MAPTKDM4EERN1POLB | |
| SCHEMBL12082493 | 0.65 | EGFR (0.37) | ALDH1A1MAPTKDM4EERN1POLB | |
| SCHEMBL12082487 | 0.65 | EGFR (0.42) | ALDH1A1MAPTKDM4EGAAERN1 | |
| SCHEMBL12082451 | 0.65 | MAPT (0.40) | ALDH1A1MAPTKDM4EGAAERN1 | |
| SCHEMBL8031695 | 0.64 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EGAATAS1R3 |
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-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |