Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 16/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.66 |
| ▸ | EGFR | P00533 | 3/20 | 0.65 |
| ▸ | TEC | P42680 | 1/20 | 0.52 |
| ▸ | BMX | P51813 | 1/20 | 0.52 |
| ▸ | CD69 | Q07108 | 1/20 | 0.52 |
| ▸ | ITK | Q08881 | 1/20 | 0.52 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.52 |
| ▸ | GP6 | Q9HCN6 | 1/20 | 0.52 |
| ▸ | NUDT5 | Q9UKK9 | 1/20 | 0.52 |
| ▸ | LCK | P06239 | 6/20 | 0.51 |
| ▸ | KDR | P35968 | 5/20 | 0.51 |
| ▸ | TEK | Q02763 | 5/20 | 0.51 |
| ▸ | LYN | P07948 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | RGS12 | O14924 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL24363230 | 0.99 | BTK (0.69) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165691 | 0.89 | BTK (0.70) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL20480850 | 0.89 | BTK (0.70) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165704 | 0.89 | BTK (0.70) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165430 | 0.88 | BTK (0.66) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165553 | 0.87 | BTK (0.60) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165937 | 0.87 | BTK (0.60) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL24363262 | 0.87 | BTK (0.68) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL14165552 | 0.87 | BTK (0.60) | BTKKCNH2EGFRTECBMX | |
| SCHEMBL23722580 | 0.85 | BTK (0.74) | BTKKCNH2EGFRTECBMX |
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-2718270-B1 | COMPOSITIONS AND METHODS FOR THE PRODUCTION OF PYRIMIDINE AND PYRIDINE COMPOUNDS WITH BTK INHIBITORY ACTIVITY | MERCK PATENT GMBH (DE) | 2022-04-27 | — | — | EP | disclosed |