Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HMGCR | P04035 | 1/20 | 0.38 |
| ▸ | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448298 | 0.88 | HMGCR (0.41) | HTR2AHTR2CHTR2BALDH1A1CYP3A4 | |
| SCHEMBL18753168 | 0.84 | HMGCR (0.43) | TAAR1ALDH1A1HMGCRKDM4EPDE3B | |
| SCHEMBL6449528 | 0.83 | ALDH1A1 (0.40) | HTR2AHTR2CHTR2BALDH1A1CYP3A4 | |
| SCHEMBL6451086 | 0.82 | ALDH1A1 (0.48) | HTR2AHTR2CALDH1A1CYP3A4HMGCR | |
| SCHEMBL10193863 | 0.78 | TAAR1 (0.40) | TAAR1ALDH1A1HMGCRKDM4E | |
| SCHEMBL6450496 | 0.78 | TAAR1 (0.45) | HTR2AHTR2CHTR2BTAAR1CALM1 | |
| SCHEMBL6451099 | 0.77 | ABCB1 (0.46) | HTR2AHTR2CHTR2BTAAR1TUBB4A | |
| Hydrochloric Acid SCHEMBL25186690 | 0.76 | HTR2A (0.61) | HTR2AHTR2CHTR2BTAAR1ALDH1A1 | |
| SCHEMBL6312974 | 0.76 | CALM1 (0.57) | HTR2AHTR2CHTR2BALDH1A1CYP3A4 | |
| SCHEMBL918847 | 0.75 | PTGS2 (0.59) | HTR2AHTR2CHTR2BTAAR1ALDH1A1 |
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 |