Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 5/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PTGES2 | Q9H7Z7 | 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 | |
|---|---|---|---|---|
| SCHEMBL2003889 | 0.93 | ALDH1A1 (0.38) | ALOX5APALOX5CYP3A4CYP2C9LMNA | |
| SCHEMBL2011328 | 0.92 | LMNA (0.40) | ALOX5APCYP3A4CYP2D6CYP2C9LMNA | |
| SCHEMBL2002164 | 0.92 | ALOX5AP (0.45) | ALOX5APALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2007346 | 0.92 | ALOX5AP (0.39) | ALOX5APALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2003941 | 0.91 | P2RX7 (0.38) | CYP3A4CYP2D6CYP2C9LMNAHTT | |
| SCHEMBL2008130 | 0.91 | ALOX5AP (0.39) | ALOX5APALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1996791 | 0.89 | PTGES2 (0.38) | ALOX5APCYP3A4CYP2D6CYP2C9LMNA | |
| SCHEMBL2006961 | 0.89 | LMNA (0.40) | ALOX5APALOX5CYP3A4LMNAMAPK1 | |
| SCHEMBL2002287 | 0.88 | L3MBTL1 (0.39) | ALOX5APALOX5CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2008737 | 0.88 | LMNA (0.42) | CYP3A4CYP2D6CYP2C9LMNAHTT |
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 |