Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.39 |
| ▸ | BACE1 | P56817 | 3/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18650896 | 0.93 | TLR8 (0.39) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18631316 | 0.90 | BACE1 (0.38) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL21297478 | 0.85 | TLR8 (0.56) | TLR8BACE1PTGS2CXCR4NUDT1 | |
| SCHEMBL18650900 | 0.82 | TLR8 (0.42) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18650876 | 0.81 | BACE1 (0.54) | TLR8BACE1PTGS2CXCR4NUDT1 | |
| SCHEMBL18650877 | 0.81 | F10 (0.39) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18650904 | 0.81 | TLR8 (0.41) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18650908 | 0.79 | BACE1 (0.38) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18650899 | 0.79 | F10 (0.39) | TLR8BACE1NTRK1CSF1RNTRK2 | |
| SCHEMBL18650897 | 0.77 | BRD4 (0.34) | NTRK1CSF1RNTRK2PTGS2BRD4 |
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-2017049068-A1 | HETEROARYL COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2017-03-23 | — | — | WO | disclosed |