Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8023142 | 0.94 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL8034312 | 0.90 | TBXA2R (0.38) | EGFR | |
| SCHEMBL8036201 | 0.89 | EPHX2 (0.39) | EGFR | |
| SCHEMBL8038463 | 0.89 | EPHX2 (0.39) | EGFR | |
| SCHEMBL8041408 | 0.84 | SMN1; SMN2 (0.32) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL8034781 | 0.81 | HPGD (0.36) | ALDH1A1KDM4EKMT2ANPC1POLB | |
| SCHEMBL8025559 | 0.79 | MAPT (0.37) | ALDH1A1KDM4EKMT2AMAPTPOLB | |
| SCHEMBL8035725 | 0.78 | KDM4E (0.43) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL8035145 | 0.78 | LRRK2 (0.35) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL8035781 | 0.77 | EPHX2 (0.41) | — |
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 |