Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.40 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 5/20 | 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 | 0.92 | NR1H4 (0.35) | L3MBTL1RAB9ALMNASMN1; SMN2TRPA1 | |
| SCHEMBL3368 | 0.87 | IP6K1 (0.39) | IP6K1IP6K3IP6K2SMN1; SMN2TRPA1 | |
| SCHEMBL7197 | 0.85 | TBXAS1 (0.39) | BRD4SMN1; SMN2TRPA1NR1H4TBXAS1 | |
| SCHEMBL7735 | 0.75 | MEN1 (0.34) | RAB9ANPC1MEN1KMT2A | |
| SCHEMBL1633 | 0.74 | NR1H4 (0.33) | SMN1; SMN2TRPA1NPC1NR1H4 | |
| SCHEMBL1294 | 0.69 | MEN1 (0.34) | SMN1; SMN2NPC1MEN1KMT2A | |
| SCHEMBL1463 | 0.68 | TSHR (0.47) | L3MBTL1RAB9ALMNASMN1; SMN2NPC1 | |
| SCHEMBL13701 | 0.67 | BRD4 (0.36) | IP6K1IP6K3IP6K2BRD4L3MBTL1 | |
| SCHEMBL14777651 | 0.67 | BRD4 (0.36) | IP6K1IP6K3IP6K2BRD4L3MBTL1 | |
| SCHEMBL8250811 | 0.67 | PTPN1 (0.36) | RAB9ASMN1; SMN2NPC1MEN1HTT |
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-2483251-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041462-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |