Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 4/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CCR9 | P51686 | 1/20 | 0.35 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2003925 | 0.94 | ALOX5 (0.39) | ALOX5APALOX5MAPTKDM4ECCR9 | |
| SCHEMBL2005862 | 0.92 | MAPT (0.41) | ALOX5APALOX5MAPTPKMKDM4E | |
| SCHEMBL2002564 | 0.92 | L3MBTL1 (0.36) | ALOX5APALOX5MAPTPKMKDM4E | |
| SCHEMBL2007478 | 0.91 | PTGES2 (0.42) | ALOX5APALOX5MAPTPKMKDM4E | |
| SCHEMBL2010313 | 0.91 | FAAH (0.42) | ALOX5APALOX5MAPTKDM4EPTGES2 | |
| SCHEMBL2004831 | 0.89 | PTGES2 (0.38) | KDM4ES1PR3PTGES2ALDH1A1CNR1 | |
| SCHEMBL2005117 | 0.89 | ALOX5AP (0.36) | ALOX5APALOX5MAPTPKMKDM4E | |
| SCHEMBL2001177 | 0.88 | ALOX5AP (0.43) | ALOX5APALOX5MAPTPKMALDH1A1 | |
| SCHEMBL2007363 | 0.88 | ALOX5AP (0.40) | ALOX5APALOX5MAPTPKMKDM4E | |
| SCHEMBL1997676 | 0.88 | ALOX5AP (0.45) | ALOX5APALOX5 |
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 |