Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MLYCD | O95822 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1247617 | 0.91 | NPC1 (0.38) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL1245152 | 0.90 | NR1H4 (0.42) | CACNA1FCACNA1DCACNA1SCACNA1CKDM4E | |
| SCHEMBL1245270 | 0.86 | KDM4E (0.44) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL2338970 | 0.85 | USP2 (0.35) | KDM4EPPARGPPARDPPARAMAPT | |
| SCHEMBL1246242 | 0.84 | PTGS2 (0.39) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL1247569 | 0.80 | SCN9A (0.39) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL2335133 | 0.78 | TP53 (0.34) | KDM4EMAPTALDH1A1MLYCDTSHR | |
| SCHEMBL1247556 | 0.78 | KDM4E (0.40) | NPC1KDM4EPPARGPPARDPPARA | |
| SCHEMBL1246914 | 0.77 | KDM4E (0.39) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL1247289 | 0.77 | KDM4E (0.39) | NPC1CACNA1FCACNA1DCACNA1SCACNA1C |
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 |