Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.40 |
| ▸ | DHFR | P00374 | 2/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6543 | 0.93 | HDAC1 (0.40) | HDAC1HDAC6HDAC8SYKTHRB | |
| SCHEMBL6811 | 0.90 | HDAC1 (0.42) | HDAC1HDAC6HDAC8MAPTPPARG | |
| SCHEMBL8174 | 0.89 | MAOB (0.41) | SYKLTB4R2 | |
| SCHEMBL7216 | 0.87 | MAOB (0.41) | MAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL11897090 | 0.87 | HDAC1 (0.36) | HDAC1HDAC6HDAC8THRBMAPT | |
| SCHEMBL1859 | 0.86 | KCNA3 (0.37) | HDAC1HDAC6HDAC8THRBMAPT | |
| SCHEMBL7176 | 0.86 | HDAC1 (0.37) | HDAC1HDAC6HDAC8THRBMAPT | |
| SCHEMBL6934 | 0.86 | FFAR4 (0.46) | HDAC1HDAC6HDAC8THRBPPARG | |
| SCHEMBL2337994 | 0.82 | HDAC6 (0.43) | HDAC1HDAC6HDAC8DHFRSYK | |
| SCHEMBL6878 | 0.82 | PTGES (0.37) | HDAC1HDAC6HDAC8MAPTKMT2A |
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-2483252-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041694-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |