Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 17/20 | 0.39 |
| ▸ | PDE6D | O43924 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | APAF1 | O14727 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GALK1 | P51570 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22183134 | 0.92 | PDK2 (0.34) | PDK2 | |
| SCHEMBL15030670 | 0.91 | PDK2 (0.35) | PDK2PDE6DTYMS | |
| SCHEMBL15213625 | 0.90 | PDK2 (0.35) | PDK2PDE6DTYMS | |
| SCHEMBL17816798 | 0.89 | PDK2 (0.35) | PDK2PDE6DTYMSMEN1APAF1 | |
| SCHEMBL22183122 | 0.89 | PDK2 (0.30) | PDK2 | |
| SCHEMBL25121505 | 0.88 | PDE6D (0.33) | PDK2PDE6D | |
| SCHEMBL8783230 | 0.85 | KDM4E (0.37) | TYMSMEN1NPC1LMNAMAPT | |
| SCHEMBL19001828 | 0.85 | PDK2 (0.39) | PDK2PDE6DTYMS | |
| SCHEMBL19001815 | 0.85 | PDK2 (0.39) | PDK2PDE6DTYMS | |
| SCHEMBL17084415 | 0.85 | PDK2 (0.39) | PDK2PDE6DMEN1APAF1NPC1 |
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-2017102063-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-06-22 | — | — | WO | disclosed |