Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.80 |
| ▸ | JAK3 | P52333 | 6/20 | 0.80 |
| ▸ | JAK2 | O60674 | 3/20 | 0.80 |
| ▸ | BLK | P51451 | 2/20 | 0.80 |
| ▸ | BMX | P51813 | 2/20 | 0.80 |
| ▸ | BTK | Q06187 | 8/20 | 0.70 |
| ▸ | CD69 | Q07108 | 1/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.68 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.68 |
| ▸ | ESR1 | P03372 | 1/20 | 0.68 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.68 |
| ▸ | HTR1A | P08908 | 1/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.68 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.68 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.68 |
| ▸ | DRD1 | P21728 | 1/20 | 0.68 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.68 |
| ▸ | PDE4A | P27815 | 1/20 | 0.68 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL21375548 | 0.89 | EGFR (0.64) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL30854720 | 0.89 | EGFR (1.00) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL93510 | 0.89 | EGFR (1.00) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL29351880 | 0.89 | EGFR (1.00) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL10127821 | 0.88 | EGFR (0.82) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL16372156 | 0.87 | EGFR (0.81) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL30672758 | 0.87 | EGFR (0.81) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL21358334 | 0.87 | BTK (0.75) | EGFRJAK3JAK2BLKBMX | |
| SCHEMBL21358184 | 0.87 | EGFR (0.65) | EGFRJAK3JAK2BLKBMX | |
| Trifluoroacetic Acid SCHEMBL21358543 | 0.86 | EGFR (0.61) | EGFRJAK3JAK2BLKBMX |
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-2019177374-A1 | 2, 4, 5-SUBSTITUTED PYRIMIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS EFFECTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF CANCER OR INFLAMMATORY DISEASE | 포로노이바이오 주식회사 | 2019-09-19 | — | — | WO | disclosed |