Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 3/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 3/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1247415 | 0.90 | TSHR (0.43) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR | |
| SCHEMBL1247195 | 0.87 | HDAC1 (0.43) | — | |
| SCHEMBL2338529 | 0.85 | LPAR1 (0.44) | CACNA1FCACNA1DCACNA1SCACNA1CABCB1 | |
| SCHEMBL1247166 | 0.85 | TSHR (0.44) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR | |
| SCHEMBL1247291 | 0.83 | SCN9A (0.41) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR | |
| SCHEMBL1246323 | 0.81 | PPARD (0.39) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR | |
| SCHEMBL1247569 | 0.81 | SCN9A (0.39) | CACNA1FCACNA1DCACNA1SCACNA1CNR1H4 | |
| SCHEMBL1245270 | 0.80 | KDM4E (0.44) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR | |
| SCHEMBL1245358 | 0.80 | NR1H4 (0.42) | CYP2C19NR1H4ALDH1A1PPARDLPAR1 | |
| SCHEMBL1247349 | 0.79 | GPBAR1 (0.39) | CACNA1FCACNA1DCACNA1SCACNA1CTSHR |
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-2462128-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-06-13 | — | — | EP | claimed |
| WO-2011017350-A2 | COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-02-10 | — | — | WO | claimed |