Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 3/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.32 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.32 |
| ▸ | TTK | P33981 | 1/20 | 0.31 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.31 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.30 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19929908 | 0.88 | ALK (0.36) | ALKJAK3ADRA1DADRA1AADRA1B | |
| SCHEMBL19930116 | 0.82 | PIP4K2C (0.41) | JAK3ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL19929854 | 0.77 | ALK (0.37) | ALKJAK3BCHEACHEAPP | |
| SCHEMBL19929855 | 0.76 | ALK (0.38) | ALKJAK3BCHEACHETRIM58 | |
| SCHEMBL19930114 | 0.76 | ALK (0.46) | ALKJAK3ADRA1ATTKPTK2 | |
| SCHEMBL19929862 | 0.76 | PIP4K2C (0.33) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL22754142 | 0.75 | PTK2 (0.50) | PTK2 | |
| SCHEMBL19929858 | 0.74 | KDM4E (0.48) | ALKPTK2 | |
| SCHEMBL18194338 | 0.72 | KHK (0.36) | ADRA1DADRA1AADRA1B | |
| SCHEMBL19929876 | 0.70 | BCHE (0.41) | ADRA1DADRA1AADRA1BBCHEACHE |
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-3290420-B1 | PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF | UNIV XIAMEN (CN) | 2020-12-09 | — | — | EP | disclosed |
| EP-3290420-A1 | PYRIMIDINE PYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND USES THEREOF | Xiamen University (CN) | 2018-03-07 | — | — | EP | disclosed |