Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.49 |
| ▸ | WHR1 | P49842 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL4138117 | 0.83 | PDE4A (0.58) | PDE4APDE4BPDE4CPDE4DWHR1 | |
| SCHEMBL13296171 | 0.72 | PDE4A (0.67) | PDE4APDE4BPDE4CPDE4DWHR1 | |
| SCHEMBL4129966 | 0.72 | ALDH1A1 (0.49) | PDE4APDE4BPDE4CPDE4DKMT2A | |
| SCHEMBL14438925 | 0.71 | MAPK14 (0.59) | PDE4APDE4BPDE4CPDE4DWHR1 | |
| SCHEMBL4133197 | 0.71 | MAPT (0.57) | — | |
| SCHEMBL16317175 | 0.69 | PDE4A (0.62) | PDE4APDE4BPDE4CPDE4DWHR1 | |
| SCHEMBL4138365 | 0.69 | MAPT (0.62) | KMT2AMEN1RXFP1ALDH1A1KDM4E | |
| SCHEMBL296765 | 0.69 | PDE4A (0.85) | PDE4APDE4BPDE4CPDE4DWHR1 | |
| SCHEMBL4154944 | 0.68 | MAPT (0.50) | RXFP1 | |
| SCHEMBL4142299 | 0.68 | MAPT (0.55) | RXFP1PTGER4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2134695-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | Exelixis, Inc. (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008112913-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | EXELIXIS, INC. (US) | 2008-09-18 | — | — | WO | disclosed |