Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 2/20 | 0.59 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.57 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.57 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.57 |
| ▸ | ESR1 | P03372 | 2/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.57 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.57 |
| ▸ | TUBB | P07437 | 2/20 | 0.57 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.57 |
| ▸ | AHR | P35869 | 2/20 | 0.57 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.57 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.57 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.57 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.57 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.57 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.57 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.57 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL699457 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL699458 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL14950253 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL13790336 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL4881152 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL631998 | 0.82 | RELA (0.81) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL29288695 | 0.80 | RELA (0.77) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL27884229 | 0.79 | TRPA1 (0.63) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL27896099 | 0.79 | TRPA1 (0.63) | RELATRPA1CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL27913396 | 0.79 | TRPA1 (0.63) | RELATRPA1CYP1A2CYP1A1CYP1B1 |
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-2008070872-A1 | PREVENTION AND TREATMENT OF COLON CANCER | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2008-06-12 | — | — | WO | disclosed |