Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL514121 | 0.83 | ALDH1A1 (0.34) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL154125 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHR | |
| SCHEMBL28082816 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL5297552 | 0.74 | ALDH1A1 (0.37) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL28082904 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL28082900 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL154989 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL31067652 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL1255356 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| Ammonia Solution, Strong SCHEMBL1252865 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR |
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-1235870-A1 | BLOCK COPOLYMERS AND METHOD FOR THE PRODUCTION AND UTILIZATION THEREOF | Rohmax Additives GmbH (DE) | 2002-09-04 | — | — | EP | disclosed |
| WO-2001040339-A1 | BLOCK COPOLYMERS AND METHOD FOR THE PRODUCTION AND UTILIZATION THEREOF | ROHMAX ADDITIVES GMBH (DE) | 2001-06-07 | — | — | WO | disclosed |