Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CTRC | Q99895 | 1/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.32 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.32 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6445 | 0.91 | CHRM1 (0.36) | ALDH1A1FFAR4MCHR1CHRM1HTR2A | |
| SCHEMBL6150 | 0.90 | BRD4 (0.36) | ALDH1A1FFAR4AOC3 | |
| SCHEMBL6613 | 0.90 | FFAR4 (0.35) | FFAR4CHRM1ALOX5LPAR1MEN1 | |
| SCHEMBL1239 | 0.88 | ABCC3 (0.42) | ALDH1A1FFAR4MCHR1CHRM1HTR2A | |
| SCHEMBL7234 | 0.87 | LPAR1 (0.34) | ALDH1A1FFAR4ALOX5ALOX5APMAPT | |
| SCHEMBL7534 | 0.85 | L3MBTL1 (0.34) | ALDH1A1MAPTLPAR1TSHR | |
| SCHEMBL7297 | 0.85 | SCD5 (0.35) | ALOX5ALOX5APLPAR1TSHRKMT2A | |
| SCHEMBL7026 | 0.84 | AOC3 (0.37) | FFAR4CHRM1ALOX5MEN1KMT2A | |
| SCHEMBL7294 | 0.84 | P2RX7 (0.36) | FFAR4MAPTKDM4ELPAR1LPAR2 | |
| SCHEMBL1323 | 0.83 | OPRM1 (0.44) | ALDH1A1MCHR1CHRM1HTR2AMAPT |
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 |