Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | GUSB | P08236 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12570776 | 0.84 | PTGS1 (0.46) | FAAH | |
| SCHEMBL3010656 | 0.80 | PTGS2 (0.49) | — | |
| SCHEMBL12570777 | 0.73 | PTGS2 (0.58) | — | |
| SCHEMBL12570781 | 0.73 | AKR1C3 (0.44) | FAAH | |
| SCHEMBL2007226 | 0.70 | PTGS2 (0.46) | — | |
| SCHEMBL1999638 | 0.70 | PTGS2 (0.59) | — | |
| SCHEMBL2006361 | 0.69 | FAAH (0.45) | FAAH | |
| SCHEMBL12570783 | 0.69 | FAAH (0.43) | FAAHCTSDGUSB | |
| SCHEMBL12570769 | 0.69 | PTGS2 (0.50) | — | |
| SCHEMBL2009964 | 0.67 | PTGS2 (0.50) | — |
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-2049520-A2 | INDOLE COMPOUNDS | Ironwood Pharmaceuticals, Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008019357-A2 | INDOLE COMPOUNDS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |