Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 12/20 | 0.42 |
| ▸ | ALK | Q9UM73 | 4/20 | 0.41 |
| ▸ | CDK4 | P11802 | 2/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.34 |
| ▸ | CCND1 | P24385 | 2/20 | 0.34 |
| ▸ | CDK2 | P24941 | 2/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18607248 | 0.95 | LCK (0.48) | LCKEGFRALK | |
| SCHEMBL18607249 | 0.95 | LCK (0.48) | LCKEGFRALK | |
| SCHEMBL18606892 | 0.91 | LCK (0.51) | LCKEGFR | |
| SCHEMBL18607244 | 0.88 | LCK (0.49) | LCKEGFRALK | |
| SCHEMBL18606983 | 0.84 | LCK (0.51) | LCKEGFRCDK4CCNA2CDK2 | |
| SCHEMBL18607342 | 0.84 | ALK (0.44) | LCKEGFRALKCCNA2CDK2 | |
| SCHEMBL20365609 | 0.82 | EGFR (0.53) | LCKEGFR | |
| SCHEMBL18607343 | 0.81 | EGFR (0.61) | EGFR | |
| SCHEMBL18607335 | 0.81 | LCK (0.54) | LCKEGFRCDK2 | |
| SCHEMBL18606898 | 0.80 | LCK (0.45) | LCKEGFRALK |
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-2017035753-A1 | 2-ARYLAMINO PYRIDINE, PYRIDINE OR TRIAZINE DERIVATIVE, PREPARATION METHOD AND USE THEREOF | 无锡双良生物科技有限公司 | 2017-03-09 | — | — | WO | disclosed |