Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | PREP | P48147 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13227748 | 0.86 | PDK1 (0.46) | PDK1PDK2PDK3PDK4TMEM97 | |
| SCHEMBL10144609 | 0.81 | SIGMAR1 (0.44) | PDK1PDK2PDK3PDK4TMEM97 | |
| SCHEMBL3783660 | 0.79 | KLK7 (0.47) | TMEM97SIGMAR1PREPNPSR1TSHR | |
| SCHEMBL13227761 | 0.74 | TMEM97 (0.49) | PDK1PDK2PDK3PDK4TMEM97 | |
| SCHEMBL29300887 | 0.73 | PDK1 (0.59) | PDK1PDK2PDK3PDK4TMEM97 | |
| SCHEMBL13260930 | 0.73 | DRD2 (0.48) | PDK1PDK2PDK3PDK4SIGMAR1 | |
| SCHEMBL11256972 | 0.72 | SMN1; SMN2 (0.49) | PREPNPSR1CYP2C19SMN1; SMN2 | |
| SCHEMBL335166 | 0.72 | MEN1 (0.59) | TMEM97SIGMAR1NPSR1CYP2C19SMN1; SMN2 | |
| SCHEMBL18851102 | 0.72 | DRD2 (0.49) | PDK1PDK2PDK3PDK4SIGMAR1 | |
| SCHEMBL13227741 | 0.72 | SIGMAR1 (0.53) | PDK1PDK2PDK3PDK4TMEM97 |
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-2079743-B1 | PTERIDINE DERIVATIVES AS POLO-LIKE KINASE INHIBITORS USEFUL IN THE TREATMENT OF CANCER | CHROMA THERAPEUTICS LTD (GB) | 2012-01-25 | — | — | EP | disclosed |