Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20155173 | 0.78 | BRD4 (0.36) | BRD4SOS1EP300GAAPOLB | |
| SCHEMBL20160312 | 0.76 | BRD4 (0.58) | BRD4EP300PTGS2 | |
| SCHEMBL16009256 | 0.73 | BRD4 (0.51) | BRD4SOS1GAAPOLBMAPT | |
| SCHEMBL16009168 | 0.70 | SOS1 (0.58) | BRD4SOS1GAAPOLBPTGS2 | |
| SCHEMBL20155147 | 0.70 | SOS1 (0.43) | SOS1GAAPOLBMAPTKMT2A | |
| SCHEMBL775451 | 0.70 | LMNA (0.44) | POLBKMT2ATDP1LMNANPSR1 | |
| SCHEMBL16009461 | 0.69 | BRD4 (0.50) | BRD4SOS1GAAPTGS2SMN1; SMN2 | |
| SCHEMBL14378231 | 0.69 | RIPK1 (0.41) | BRD4EP300PTGS2CNR1CNR2 | |
| SCHEMBL29515645 | 0.68 | PTPRB (0.36) | BRD4EP300KMT2ATDP1NPSR1 | |
| SCHEMBL26956218 | 0.68 | PTPRB (0.36) | BRD4EP300KMT2ATDP1NPSR1 |
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-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |