Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.68 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.62 |
| ▸ | IGF1R | P08069 | 2/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.62 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | GAK | O14976 | 1/20 | 0.55 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.55 |
| ▸ | JAK2 | O60674 | 1/20 | 0.55 |
| ▸ | FLT3 | P36888 | 1/20 | 0.55 |
| ▸ | BLK | P51451 | 1/20 | 0.55 |
| ▸ | BMX | P51813 | 1/20 | 0.55 |
| ▸ | JAK3 | P52333 | 1/20 | 0.55 |
| ▸ | CTSC | P53634 | 1/20 | 0.55 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.55 |
| ▸ | BTK | Q06187 | 1/20 | 0.55 |
| ▸ | ITK | Q08881 | 1/20 | 0.55 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.55 |
| ▸ | DCLK3 | Q9C098 | 1/20 | 0.55 |
| ▸ | NUAK2 | Q9H093 | 1/20 | 0.55 |
| ▸ | EML4 | Q9HC35 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL17196683 | 0.88 | EGFR (0.65) | EGFRALKIGF1RKCNH2PLK4 | |
| SCHEMBL17196847 | 0.88 | EGFR (0.63) | EGFRALKIGF1RKCNH2 | |
| SCHEMBL18657398 | 0.85 | EGFR (0.69) | EGFRIGF1RKCNH2JAK2JAK3 | |
| SCHEMBL18657453 | 0.85 | EGFR (0.69) | EGFRIGF1RKCNH2JAK2JAK3 | |
| SCHEMBL17467224 | 0.84 | EGFR (0.69) | EGFRIGF1RKCNH2JAK3 | |
| SCHEMBL18657447 | 0.83 | EGFR (0.55) | EGFRALKIGF1RKCNH2 | |
| SCHEMBL18359226 | 0.83 | EGFR (0.70) | EGFRALKIGF1RKCNH2JAK3 | |
| SCHEMBL19027763 | 0.83 | EGFR (0.72) | EGFRALKIGF1RKCNH2JAK3 | |
| SCHEMBL19027795 | 0.82 | EGFR (0.68) | EGFRALKIGF1RKCNH2PLK4 | |
| SCHEMBL18369580 | 0.81 | EGFR (0.83) | EGFRALKIGF1RKCNH2 |
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-2015158233-A1 | 2,3,4,6-TETRA-SUBSTITUTED BENZENE-1,5-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF | 上海海雁医药科技有限公司 | 2015-10-22 | — | — | WO | disclosed |