Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MLNR | O43193 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7121 | 0.89 | LPAR1 (0.35) | ALDH1A1MLNRLMNAPPARGBRD4 | |
| SCHEMBL7396 | 0.89 | CYP4F2 (0.35) | CYP4F2CYP4A11ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL6661 | 0.81 | FFAR1 (0.41) | ALDH1A1SMN1; SMN2KDM4EL3MBTL1LMNA | |
| SCHEMBL6236 | 0.78 | GAA (0.34) | BRD4 | |
| SCHEMBL12783 | 0.78 | LPAR1 (0.36) | ALDH1A1MLNRMEN1KMT2A | |
| SCHEMBL14629 | 0.77 | LPAR1 (0.39) | ALDH1A1PKMSMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL7501 | 0.77 | ABCC3 (0.37) | SLC6A4KCNH2 | |
| SCHEMBL6705 | 0.72 | LPAR1 (0.44) | ALDH1A1SMN1; SMN2CYP2D6BRD4MEN1 | |
| SCHEMBL6296 | 0.71 | LPAR1 (0.48) | L3MBTL1HPGD | |
| SCHEMBL3709527 | 0.70 | CYP2D6 (0.39) | ALDH1A1PKMMLNRCYP2D6SLC6A2 |
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 |