Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.60 |
| ▸ | SRC | P12931 | 1/20 | 0.60 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.48 |
| ▸ | TUBB | P07437 | 1/20 | 0.48 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.48 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.48 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.48 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.48 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.48 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.48 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.48 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.48 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.48 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.48 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.48 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.48 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4225120 | 0.87 | EGFR (0.60) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL28287395 | 0.85 | EGFR (0.68) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL18160178 | 0.76 | EGFR (0.68) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL29988920 | 0.75 | EGFR (0.66) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL8998857 | 0.75 | EGFR (1.00) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL9051693 | 0.75 | EGFR (0.66) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL28287467 | 0.72 | EGFR (0.61) | EGFRSRCTUBB4ATUBBTUBA3C | |
| SCHEMBL31405650 | 0.72 | ALDH1A1 (0.59) | ALDH1A1TSHRHTTKMT2APOLB | |
| SCHEMBL8691693 | 0.72 | TUBB4A (0.51) | EGFRSRCTUBB4ATUBBTUBA3C | |
| Carbazole SCHEMBL1352178 | 0.69 | EGFR (0.54) | EGFRSRCALDH1A1TSHRHTT |
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-2009006089-A2 | A2 ADENOSINE RECEPTOR AGONISTS | GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2009-01-08 | — | — | WO | disclosed |