Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 6/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 3/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL2004983 | 0.94 | PTGES2 (0.42) | PTGES2MEN1HTTKMT2AALDH1A1 | |
| SCHEMBL2002558 | 0.92 | RET (0.39) | PTGES2KMT2AALDH1A1NPSR1MAPT | |
| SCHEMBL2005007 | 0.92 | PTGES2 (0.40) | PTGES2ALDH1A1NPSR1MAPTKDM4E | |
| SCHEMBL2006486 | 0.91 | PTGES2 (0.41) | PTGES2FAAHMEN1HTTKMT2A | |
| SCHEMBL2006095 | 0.91 | FAAH (0.39) | PTGES2FAAHMEN1HTTKMT2A | |
| SCHEMBL2002012 | 0.90 | PTGES2 (0.40) | PTGES2MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL2001534 | 0.90 | HDAC6 (0.41) | PTGES2MEN1KMT2AALDH1A1NPSR1 | |
| SCHEMBL2004598 | 0.89 | ALOX5AP (0.41) | PTGES2KMT2AMAPTS1PR1ALOX5AP | |
| SCHEMBL2007848 | 0.87 | PTGES2 (0.45) | PTGES2FAAHMEN1HTTKMT2A | |
| SCHEMBL2004618 | 0.86 | PTGES2 (0.43) | PTGES2FAAHMEN1HTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7960544-B2 | Useful indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |