Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 3/20 | 0.36 |
| ▸ | KHK | P50053 | 3/20 | 0.35 |
| ▸ | TRIM58 | Q8NG06 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.33 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19930112 | 0.88 | ALK (0.38) | ALKTRIM58BCHEACHEJAK3 | |
| SCHEMBL18194338 | 0.83 | KHK (0.36) | KHKADRA1DADRA1AADRA1B | |
| SCHEMBL19929854 | 0.81 | ALK (0.37) | ALKTRIM58BCHEACHEJAK3 | |
| SCHEMBL19929876 | 0.81 | BCHE (0.41) | TRIM58BCHEACHEADRA1DADRA1A | |
| SCHEMBL19930114 | 0.80 | ALK (0.46) | ALKIGF1RJAK3ADRA1APTK2 | |
| SCHEMBL22754142 | 0.79 | PTK2 (0.50) | PTK2 | |
| SCHEMBL19929858 | 0.77 | KDM4E (0.48) | ALKPTK2 | |
| SCHEMBL19929855 | 0.76 | ALK (0.38) | ALKTRIM58BCHEACHEJAK3 | |
| SCHEMBL19929884 | 0.73 | PTK2 (0.37) | KHKTRIM58IGF1RBCHEACHE | |
| SCHEMBL19930116 | 0.72 | PIP4K2C (0.41) | TRIM58BCHEACHEJAK3ADRA1D |
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 |