Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | POLR1A | O95602 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL366312 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TDP1KMT2AMEN1CYP1A2 | |
| SCHEMBL364887 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL366408 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL364443 | 0.85 | ALDH1A1 (0.45) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL365609 | 0.85 | ALDH1A1 (0.48) | ALDH1A1TDP1KMT2AMEN1CYP1A2 | |
| SCHEMBL365801 | 0.85 | ALDH1A1 (0.51) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL365839 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL364969 | 0.84 | KDM4E (0.53) | ALDH1A1KMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL364682 | 0.84 | KMT2A (0.58) | ALDH1A1KMT2AMEN1CYP1A2CYP2C19 | |
| SCHEMBL367151 | 0.84 | ALDH1A1 (0.47) | ALDH1A1TDP1KMT2AMEN1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |