Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.69 |
| ▸ | CA12 | O43570 | 3/20 | 0.69 |
| ▸ | CA4 | P22748 | 3/20 | 0.69 |
| ▸ | CA7 | P43166 | 3/20 | 0.69 |
| ▸ | TYR | P14679 | 1/20 | 0.69 |
| ▸ | NQO2 | P16083 | 1/20 | 0.63 |
| ▸ | CBS | P35520 | 1/20 | 0.62 |
| ▸ | P4HB | P07237 | 3/20 | 0.61 |
| ▸ | CA2 | P00918 | 2/20 | 0.61 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | RPS6KA3 | P51812 | 4/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | ALPI | P09923 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9992609 | 1.00 | CYP3A4 (0.69) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL1278982 | 1.00 | CYP3A4 (0.69) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL18670353 | 1.00 | CYP3A4 (0.69) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL181120 | 0.95 | KDM4E (0.65) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL1279100 | 0.92 | CYP3A4 (0.59) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL2510457 | 0.87 | NQO2 (0.72) | CYP3A4CA12CA4CA7NQO2 | |
| SCHEMBL2002343 | 0.85 | CA12 (0.65) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL572192 | 0.85 | CYP3A4 (0.60) | CYP3A4CA12CA4CA7TYR | |
| SCHEMBL2007120 | 0.84 | NQO2 (0.65) | CYP3A4CA12CA4CA7NQO2 | |
| Tiliroside SCHEMBL23597 | 0.82 | CA12 (1.00) | CYP3A4CA12CA4CA7TYR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2624702-A2 | ANTI-BIOFILM COMPOSITIONS AND METHODS FOR USING | The Board of Trustees of The University of Arkansas (US) | 2013-08-14 | — | — | EP | claimed |
| WO-2012048119-A2 | ANTI-BIOFILM COMPOSITIONS AND METHODS FOR USING | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ARKANSAS (US) | 2012-04-12 | — | — | WO | claimed |
| EP-2624702-A2 | ANTI-BIOFILM COMPOSITIONS AND METHODS FOR USING | The Board of Trustees of The University of Arkansas (US) | 2013-08-14 | — | — | EP | disclosed |
| WO-2012048119-A2 | ANTI-BIOFILM COMPOSITIONS AND METHODS FOR USING | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ARKANSAS (US) | 2012-04-12 | — | — | WO | disclosed |