Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | AHR | P35869 | 2/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9960061 | 1.00 | RELA (0.49) | RELAESR1AHRTAS1R3TAS1R1 | |
| SCHEMBL9959953 | 0.87 | TAS1R3 (0.48) | RELAAHRTAS1R3TAS1R1MAPT | |
| SCHEMBL9959963 | 0.87 | TAS1R3 (0.48) | RELAAHRTAS1R3TAS1R1MAPT | |
| SCHEMBL4271096 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL4262233 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL9955047 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL4264101 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL9955051 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL2787091 | 0.80 | EGFR (0.44) | MAPTTP53SMN1; SMN2TUBB4ATUBB | |
| SCHEMBL9955641 | 0.79 | TOP2A (0.52) | NPC1RAB9AMAPTTUBB1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2655307-A1 | COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS | Givaudan SA (CH) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012085287-A1 | COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS | GIVAUDAN SA (CH) | 2012-06-28 | — | — | WO | disclosed |