Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 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 | |
|---|---|---|---|---|
| SCHEMBL2001856 | 0.92 | LMNA (0.36) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2005704 | 0.91 | FAAH (0.39) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2003403 | 0.90 | LMNA (0.38) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2004892 | 0.90 | LMNA (0.35) | ALDH1A1MAPTLMNAKDM4EMAPK1 | |
| SCHEMBL2002764 | 0.89 | PTGES2 (0.36) | ALDH1A1MAPTLMNAKDM4EMAPK1 | |
| SCHEMBL2002258 | 0.89 | LMNA (0.39) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2005294 | 0.89 | FAAH (0.41) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2005876 | 0.88 | LMNA (0.50) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL1999889 | 0.88 | LMNA (0.42) | ALDH1A1MAPTLMNAKDM4EMITF | |
| SCHEMBL2007916 | 0.87 | LMNA (0.41) | ALDH1A1MAPTLMNAKDM4EMAPK1 |
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 |