Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 5/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RGS12 | O14924 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2006833 | 0.94 | PLA2G2A (0.44) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2011749 | 0.91 | LMNA (0.38) | ALOX5APMAPTSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL2004999 | 0.90 | ALOX5AP (0.40) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2009777 | 0.90 | FAAH (0.41) | CYP3A4MAPTKMT2ASMN1; SMN2LMNA | |
| SCHEMBL2008598 | 0.90 | ALOX5AP (0.40) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2003946 | 0.89 | ALOX5AP (0.42) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2002167 | 0.89 | ALOX5AP (0.43) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2002957 | 0.88 | FAAH (0.44) | MAPTKMT2ALMNAMEN1ALDH1A1 | |
| SCHEMBL2004677 | 0.88 | MAPT (0.41) | ALOX5APALOX5CYP3A4CYP2C9MAPT | |
| SCHEMBL2000884 | 0.87 | FAAH (0.44) | — |
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 |