Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.70 |
| ▸ | MAPT | P10636 | 12/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.67 |
| ▸ | MEN1 | O00255 | 7/20 | 0.67 |
| ▸ | LMNA | P02545 | 4/20 | 0.67 |
| ▸ | ATM | Q13315 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 7/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.66 |
| ▸ | HTT | P42858 | 6/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.65 |
| ▸ | POLB | P06746 | 2/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL880413 | 0.88 | ALDH1A1 (0.77) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL880478 | 0.81 | ALDH1A1 (0.84) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL13522300 | 0.81 | ALDH1A1 (0.88) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL880258 | 0.81 | NPSR1 (0.92) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL21295 | 0.80 | KMT2A (0.70) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL29668346 | 0.80 | KMT2A (0.70) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL880412 | 0.79 | ALDH1A1 (0.84) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL10280604 | 0.79 | TDP1 (1.00) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL880480 | 0.78 | MAPT (1.00) | ALDH1A1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL16387688 | 0.78 | MAPT (0.62) | ALDH1A1KDM4EMAPTKMT2AMEN1 |
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-2433634-A2 | Compounds, compositions and methods of inhibiting a-synuclein toxicity | The Whitehead Institute for Biomedical Research (US) | 2012-03-28 | — | — | EP | disclosed |