Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 8/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.38 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL2002804 | 0.94 | NPC1 (0.45) | SMN1; SMN2MAPTKMT2ACYP3A4CYP2C9 | |
| SCHEMBL2004994 | 0.93 | MAPT (0.44) | MAPTKMT2ACYP3A4CYP2C9LMNA | |
| SCHEMBL2001259 | 0.91 | SMN1; SMN2 (0.39) | SMN1; SMN2MAPTKMT2AALOX5APNPC1 | |
| SCHEMBL2006770 | 0.90 | GRM5 (0.42) | SMN1; SMN2MAPTKMT2ACYP3A4NPC1 | |
| SCHEMBL2007692 | 0.90 | ALOX5AP (0.39) | SMN1; SMN2MAPTKMT2AALOX5APALOX5 | |
| SCHEMBL2004420 | 0.89 | FAAH (0.44) | SMN1; SMN2MAPTKMT2ANPC1RAB9A | |
| SCHEMBL2003750 | 0.88 | FAAH (0.40) | SMN1; SMN2MAPTKMT2ANPC1RAB9A | |
| SCHEMBL2005817 | 0.87 | SMPD1 (0.44) | SMN1; SMN2MAPTKMT2AALOX5APALOX5 | |
| SCHEMBL2001509 | 0.86 | FAAH (0.43) | KMT2AFAAHCES1NCEH1DAGLA | |
| SCHEMBL2002872 | 0.86 | PLA2G2A (0.49) | SMN1; SMN2MAPTKMT2ACYP3A4CYP2C9 |
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 |