Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 11/20 | 0.60 |
| ▸ | EGFR | P00533 | 2/20 | 0.60 |
| ▸ | PTK2 | Q05397 | 9/20 | 0.58 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.54 |
| ▸ | MET | P08581 | 7/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.53 |
| ▸ | INSR | P06213 | 1/20 | 0.53 |
| ▸ | ROS1 | P08922 | 1/20 | 0.53 |
| ▸ | FER | P16591 | 1/20 | 0.53 |
| ▸ | LTK | P29376 | 1/20 | 0.53 |
| ▸ | BLK | P51451 | 1/20 | 0.53 |
| ▸ | BTK | Q06187 | 1/20 | 0.53 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.53 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.53 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.53 |
| ▸ | EML4 | Q9HC35 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL19027409 | 0.86 | ALK (0.67) | ALKEGFRPTK2ZAP70MET | |
| SCHEMBL19027800 | 0.80 | ALK (0.67) | ALKEGFRPTK2METERBB2 | |
| SCHEMBL19027408 | 0.79 | ALK (0.58) | ALKEGFRPTK2ZAP70MET | |
| SCHEMBL2595197 | 0.78 | ALK (0.78) | ALKEGFRMET | |
| SCHEMBL19027387 | 0.78 | ALK (0.79) | ALKEGFRPTK2ZAP70MET | |
| SCHEMBL19027802 | 0.77 | EGFR (0.79) | ALKEGFRPTK2ZAP70ERBB2 | |
| SCHEMBL19027405 | 0.77 | ALK (0.89) | ALKEGFRPTK2ERBB2INSR | |
| SCHEMBL19027794 | 0.77 | ALK (0.95) | ALKEGFRPTK2ZAP70MET | |
| SCHEMBL19027548 | 0.77 | ALK (0.65) | ALKEGFRPTK2METERBB2 | |
| SCHEMBL19027410 | 0.77 | ALK (0.82) | ALKEGFRPTK2METERBB2 |
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-2017101803-A1 | NOVEL EGFR AND ALK DUAL INHIBITOR | 合肥中科普瑞昇生物医药科技有限公司 | 2017-06-22 | — | — | WO | disclosed |