Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 9/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL1736 | 0.93 | NR1H4 (0.35) | TBXAS1NR1H4TRPA1ALDH1A1MAPT | |
| SCHEMBL4758 | 0.85 | IP6K1 (0.40) | TBXAS1NR1H4TRPA1SMN1; SMN2BRD4 | |
| SCHEMBL3368 | 0.84 | IP6K1 (0.39) | TRPA1SMN1; SMN2 | |
| SCHEMBL7735 | 0.84 | MEN1 (0.34) | MAPT | |
| SCHEMBL1633 | 0.79 | NR1H4 (0.33) | NR1H4TRPA1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7129 | 0.72 | BRD4 (0.36) | ALDH1A1MAPTSMN1; SMN2BRD4CYP1A2 | |
| SCHEMBL8250811 | 0.70 | PTPN1 (0.36) | NR1H4ALDH1A1MAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL1563 | 0.70 | PTPN1 (0.47) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1294 | 0.70 | MEN1 (0.34) | ALDH1A1MAPTSMN1; SMN2CYP1A2CYP2C9 | |
| SCHEMBL1379 | 0.69 | GAA (0.39) | NR1H4ALDH1A1MAPTSMN1; SMN2BRD4 |
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 |