Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 8/20 | 0.43 |
| ▸ | JAK2 | O60674 | 6/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18376779 | 0.94 | TBK1 (0.50) | TBK1EGFRJAK3JAK2MAPK10 | |
| SCHEMBL18376856 | 0.93 | JAK2 (0.51) | TBK1JAK3JAK2MAPK10SYK | |
| SCHEMBL18377059 | 0.90 | CDK1 (0.51) | TBK1JAK3JAK2MAPK10MCHR1 | |
| SCHEMBL18376839 | 0.88 | EGFR (0.53) | EGFRJAK3JAK2MAPK10SYK | |
| SCHEMBL18376785 | 0.88 | TBK1 (0.48) | TBK1EGFRJAK3JAK2SYK | |
| SCHEMBL18376855 | 0.86 | JAK2 (0.58) | TBK1JAK3JAK2MAPK10SYK | |
| SCHEMBL18376780 | 0.86 | TBK1 (0.49) | TBK1EGFRJAK3JAK2MAPK10 | |
| SCHEMBL18376857 | 0.85 | EGFR (0.58) | TBK1EGFRJAK3JAK2MAPK10 | |
| SCHEMBL18377058 | 0.84 | JAK2 (0.59) | TBK1JAK3JAK2MAPK10MCHR1 | |
| SCHEMBL18376762 | 0.83 | JAK2 (0.51) | EGFRJAK3JAK2MAPK10SRC |
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-2017005137-A1 | QUINAZOLINE COMPOUND, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF | 吉林大学 | 2017-01-12 | — | — | WO | disclosed |