Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.68 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.66 |
| ▸ | EML4 | Q9HC35 | 3/20 | 0.65 |
| ▸ | MLNR | O43193 | 1/20 | 0.64 |
| ▸ | KDM1A | O60341 | 1/20 | 0.64 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.64 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.64 |
| ▸ | INSR | P06213 | 1/20 | 0.64 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.64 |
| ▸ | HTR1A | P08908 | 1/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.64 |
| ▸ | DRD2 | P14416 | 1/20 | 0.64 |
| ▸ | NQO2 | P16083 | 1/20 | 0.64 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.64 |
| ▸ | DRD1 | P21728 | 1/20 | 0.64 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.64 |
| ▸ | HTR2A | P28223 | 1/20 | 0.64 |
| ▸ | HTR2C | P28335 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL19337036 | 0.93 | EGFR (0.65) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL19337019 | 0.93 | EGFR (0.65) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL23937949 | 0.93 | EGFR (0.66) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL19608106 | 0.89 | EGFR (0.62) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL20892583 | 0.88 | EGFR (0.70) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL23154881 | 0.88 | EGFR (0.56) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL20892400 | 0.86 | EGFR (0.68) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL19337177 | 0.86 | EGFR (0.76) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL24069005 | 0.86 | EGFR (0.67) | EGFRALKKCNH2EML4MLNR | |
| SCHEMBL20674715 | 0.85 | EGFR (0.68) | EGFRALKKCNH2EML4MLNR |
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-3885344-A2 | PYRIMIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF | InventisBio Co., Ltd. (CN) | 2021-09-29 | — | — | EP | disclosed |
| EP-3216786-A1 | PYRIMIDINE OR PYRIDINE COMPOUNDS, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USES THEREOF | Shanghai Shaletech Technology Co., Ltd. (CN) | 2017-09-13 | — | — | EP | disclosed |