Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.58 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.58 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.50 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.50 |
| ▸ | TUBB | P07437 | 2/20 | 0.50 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.50 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.50 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.50 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.50 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.50 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.50 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.50 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.50 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.50 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.50 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.50 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.50 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6450699 | 0.90 | TUBB4A (0.62) | CYP1A2CYP1A1CYP1B1NFE2L2TUBB4A | |
| SCHEMBL6453084 | 0.86 | NFE2L2 (0.60) | CYP1A2CYP1A1CYP1B1NFE2L2TUBB4A | |
| SCHEMBL6449517 | 0.85 | PTGS2 (0.54) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL6449438 | 0.84 | PTGS2 (0.46) | CYP1A2CYP1A1CYP1B1NFE2L2PTGS2 | |
| SCHEMBL6449543 | 0.84 | NFE2L2 (0.54) | CYP1A2CYP1A1CYP1B1NFE2L2TUBB4A | |
| SCHEMBL6448335 | 0.82 | PTGS2 (0.43) | CYP1A2CYP1A1CYP1B1TRPA1PTGS2 | |
| SCHEMBL917865 | 0.82 | TUBB1 (0.62) | CYP1A2CYP1A1CYP1B1NFE2L2TRPA1 | |
| SCHEMBL6453162 | 0.82 | TUBB1 (0.62) | CYP1A2CYP1A1CYP1B1NFE2L2TRPA1 | |
| SCHEMBL6448352 | 0.80 | CYP1A1 (0.45) | CYP1A2CYP1A1CYP1B1NFE2L2TUBB4A | |
| SCHEMBL6448427 | 0.78 | CYP1A1 (0.43) | CYP1A2CYP1A1CYP1B1NFE2L2TUBB4A |
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-1554236-A1 | NOVEL BIOACTIVE DIPHENYL ETHENE COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS | Welichem Biotech Inc. (CA) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004031117-A1 | NOVEL BIOACTIVE DIPHENYL ETHENE COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS | WELICHEM BIOTECH INC. (CA) | 2004-04-15 | — | — | WO | disclosed |