Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1245176 | 0.92 | NR1H4 (0.40) | GPBAR1ALDH1A1MAPTHPGDPOLB | |
| SCHEMBL1245358 | 0.90 | NR1H4 (0.42) | GPBAR1ALDH1A1MAPTHPGDPOLB | |
| SCHEMBL1247132 | 0.90 | GPBAR1 (0.44) | GPBAR1ALDH1A1MAPTHPGDPOLB | |
| SCHEMBL1246186 | 0.89 | PTGDR2 (0.38) | GPBAR1ALDH1A1MAPTHPGDPOLB | |
| SCHEMBL1247141 | 0.88 | GPBAR1 (0.37) | GPBAR1ALDH1A1MAPTHPGDPOLB | |
| SCHEMBL1246460 | 0.88 | PPARD (0.39) | GPBAR1ALDH1A1HPGDSCN9ALMNA | |
| SCHEMBL1246346 | 0.88 | SCN9A (0.38) | GPBAR1ALDH1A1MAPTSCN9A | |
| SCHEMBL1246477 | 0.87 | NR1H4 (0.42) | GPBAR1ALDH1A1MAPTPTGDR2 | |
| SCHEMBL3709238 | 0.86 | LPAR1 (0.41) | HPGDPTGDR2LMNA | |
| SCHEMBL1247222 | 0.86 | ALDH1A1 (0.36) | GPBAR1ALDH1A1MAPTHPGDPOLB |
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 |