Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 1/20 | 0.45 |
| ▸ | CLK1 | P49759 | 2/20 | 0.37 |
| ▸ | CLK2 | P49760 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.37 |
| ▸ | CLK3 | P49761 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31364613 | 0.74 | JAK2 (0.43) | EGFRJAK2JAK1CLK1CLK2 | |
| SCHEMBL31364628 | 0.72 | JAK2 (0.52) | EGFRJAK2JAK1CLK1CLK2 | |
| SCHEMBL31364650 | 0.69 | JAK2 (0.48) | EGFRJAK2JAK1CLK1CLK2 | |
| SCHEMBL20824798 | 0.68 | EGFR (0.51) | EGFR | |
| SCHEMBL31364618 | 0.68 | JAK2 (0.47) | EGFRJAK2JAK1CLK1CLK2 | |
| SCHEMBL31364649 | 0.67 | JAK2 (0.46) | EGFRJAK2JAK1CLK1CLK2 | |
| SCHEMBL21984994 | 0.65 | ALDH1A1 (0.44) | EGFRCLK1CLK4KDM4ECYP1A2 | |
| SCHEMBL29354104 | 0.65 | EGFR (0.46) | EGFR | |
| SCHEMBL18367753 | 0.65 | EGFR (0.46) | EGFR | |
| SCHEMBL19762917 | 0.63 | JAK2 (0.45) | EGFRJAK2JAK1CLK1CLK2 |
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-3478674-B1 | 4,6-DIAMINOQUINAZOLINES AS COT MODULATORS AND METHODS OF USE THEREOF | GILEAD SCIENCES INC (US) | 2020-05-13 | — | — | EP | disclosed |