Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | RET | P07949 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2005430 | 0.95 | LMNA (0.41) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2000312 | 0.92 | LMNA (0.39) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2002603 | 0.91 | MAPT (0.40) | LMNATSHRGSK3BMAPTALDH1A1 | |
| SCHEMBL2005843 | 0.91 | GSK3B (0.40) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2002120 | 0.90 | ABCB1 (0.41) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2004501 | 0.90 | LMNA (0.43) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2009630 | 0.90 | CYP1A2 (0.45) | GSK3BMAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2008018 | 0.89 | GSK3B (0.44) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2002951 | 0.88 | S1PR1 (0.41) | LMNATSHRMAPK1L3MBTL1GSK3B | |
| SCHEMBL2000706 | 0.87 | RET (0.39) | LMNATSHRMAPK1L3MBTL1RET |
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 |