Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.52 |
| ▸ | CES2 | O00748 | 7/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | HSD17B3 | P37058 | 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 | |
|---|---|---|---|---|
| SCHEMBL9822754 | 0.82 | CES2 (0.60) | CES1CES2TSHRALDH1A1 | |
| SCHEMBL27749369 | 0.79 | — | — | |
| SCHEMBL4915612 | 0.78 | CES2 (0.50) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL4915610 | 0.78 | CES2 (0.50) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL25897532 | 0.75 | CES2 (0.46) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL6138662 | 0.74 | — | — | |
| SCHEMBL531304 | 0.74 | — | — | |
| SCHEMBL17165296 | 0.74 | — | — | |
| SCHEMBL531303 | 0.74 | — | — | |
| SCHEMBL26463488 | 0.73 | HCAR2 (0.54) | CES1CES2HDAC3HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160194263-A1 | Method for Producing N-Butane Derivatives | OXEA GMBH (DE) | 2016-07-07 | — | — | US | disclosed |
| US-20100034798-A1 | COMPOSITION AND METHOD OF USE FOR INTESTINAL HEALTH | VANKOMEN DAVID | 2010-02-11 | — | — | US | disclosed |