Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.37 |
| ▸ | KDM5A | P29375 | 2/20 | 0.37 |
| ▸ | GABRP | O00591 | 3/20 | 0.36 |
| ▸ | GABRD | O14764 | 3/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3195705 | 0.90 | ALDH1A1 (0.42) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL3187223 | 0.80 | FFAR3 (0.44) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL14071943 | 0.80 | AKR1B1 (0.44) | ALDH1A1HDAC11TSHRKMT2ALMNA | |
| SCHEMBL11212413 | 0.80 | GABRP (0.41) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL4247084 | 0.80 | GABRP (0.42) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL20780373 | 0.77 | AKR1B1 (0.46) | ALDH1A1HDAC11TSHRKMT2ALMNA | |
| SCHEMBL11342740 | 0.77 | AKR1B1 (0.46) | ALDH1A1KDM4CKDM5AHDAC11TSHR | |
| SCHEMBL3188482 | 0.76 | L3MBTL1 (0.33) | ALDH1A1ALDH2GABRPGABRDGABRA1 | |
| Stearic Acid SCHEMBL20142565 | 0.75 | GPR84 (0.59) | ALDH1A1HDAC11TSHRKMT2AAKR1B1 | |
| Stearic Acid SCHEMBL20142766 | 0.75 | GPR84 (0.59) | ALDH1A1HDAC11TSHRKMT2AAKR1B1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1880711-A1 | PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT AND EXTERNAL COMPOSITION FOR SKIN | Shiseido Company, Limited (JP) | 2008-01-23 | — | — | EP | disclosed |