Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6450498 | 0.87 | HTR2A (0.47) | ABCB1HTR2ATAAR1 | |
| SCHEMBL6448298 | 0.83 | HMGCR (0.41) | CALM1HMGCRTUBB4ATUBBTUBA3C | |
| SCHEMBL6451089 | 0.81 | KDM4E (0.41) | CYP1A2HMGCRHTR2ATAAR1ALDH1A1 | |
| SCHEMBL6451103 | 0.79 | PARP15 (0.43) | CYP1A2ABCB1TAAR1ALOX5 | |
| SCHEMBL7070361 | 0.77 | NPC1 (0.33) | CALM1HMGCRHTR2ATAAR1CYP3A4 | |
| SCHEMBL8009626 | 0.76 | CYP1A2 (0.44) | CYP1A2CALM1HMGCRTAAR1ALDH1A1 | |
| SCHEMBL6312974 | 0.75 | CALM1 (0.57) | CALM1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL9145125 | 0.75 | CYP1A2 (0.46) | CYP1A2HMGCRTAAR1ALDH1A1ALOX5 | |
| SCHEMBL13548286 | 0.74 | PTGS2 (0.47) | CALM1HMGCRHTR2ATAAR1ALDH1A1 | |
| SCHEMBL6452983 | 0.73 | HTR2A (0.39) | CALM1HMGCRTUBB4ATUBBTUBA3C |
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 | claimed |
| WO-2004031117-A1 | NOVEL BIOACTIVE DIPHENYL ETHENE COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS | WELICHEM BIOTECH INC. (CA) | 2004-04-15 | — | — | WO | claimed |