Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.40 |
| ▸ | APP | P05067 | 3/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL997616 | 1.00 | KDM4E (0.44) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL997802 | 0.99 | KDM4E (0.43) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| Water SCHEMBL997173 | 0.98 | KDM4E (0.43) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL997801 | 0.94 | KDM4E (0.44) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| Water SCHEMBL997172 | 0.93 | KDM4E (0.43) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL997744 | 0.88 | TUBB1 (0.47) | KDM4ELMNAABCG2APPTUBB4A | |
| SCHEMBL997749 | 0.88 | TUBB1 (0.47) | KDM4ELMNAABCG2APPTUBB4A | |
| SCHEMBL997556 | 0.87 | TUBB1 (0.48) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL997553 | 0.87 | TUBB1 (0.48) | KDM4EPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL996237 | 0.82 | TUBB4A (0.61) | KDM4EPDE4APDE4BPDE4CPDE4D |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |