Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.40 |
| ▸ | PPARD | Q03181 | 5/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | VDR | P11473 | 2/20 | 0.39 |
| ▸ | RXRA | P19793 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.38 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.38 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2336634 | 0.93 | LPAR1 (0.43) | ALDH1A1THRBLPAR1LPAR2LPAR3 | |
| SCHEMBL3702563 | 0.92 | NR1H4 (0.46) | ALOX5ALOX5APPPARDNR1H4LPAR1 | |
| SCHEMBL3714445 | 0.88 | LPAR1 (0.38) | ALDH1A1NPC1RAB9ALPAR1LPAR2 | |
| SCHEMBL2339543 | 0.87 | LPAR1 (0.42) | ALDH1A1NPC1RAB9ATHRBLPAR1 | |
| SCHEMBL3717698 | 0.86 | P2RX3 (0.38) | ALDH1A1PPARDESR1THRATHRB | |
| SCHEMBL3707582 | 0.86 | LPAR1 (0.39) | ALDH1A1NPC1RAB9ALPAR1LPAR2 | |
| SCHEMBL3700510 | 0.85 | LPAR1 (0.36) | ALDH1A1NPC1RAB9APPARDPPARG | |
| SCHEMBL3710883 | 0.85 | NR1H4 (0.48) | PPARDESR1THRATHRBVDR | |
| SCHEMBL3700609 | 0.84 | LPAR1 (0.46) | ALDH1A1PPARDNR1H4LPAR1LPAR2 | |
| SCHEMBL3704465 | 0.84 | TBXAS1 (0.36) | ALDH1A1ALOX5ALOX5APRXRALPAR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010077882-A2 | ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS | AMIRA PHARMACEUTICALS, INC. (US) | 2010-07-08 | — | — | WO | disclosed |