Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 6/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 5/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2009144 | 0.93 | CYP3A4 (0.38) | MCL1MEN1KMT2APTGES2ALOX5AP | |
| SCHEMBL2002269 | 0.92 | LMNA (0.35) | FAAHMCL1MEN1HTTKMT2A | |
| SCHEMBL2007516 | 0.91 | S1PR3 (0.38) | MCL1MEN1KMT2APTGES2ALOX5AP | |
| SCHEMBL2003713 | 0.91 | MCL1 (0.39) | MCL1MEN1KMT2APTGES2CYP3A4 | |
| SCHEMBL2002780 | 0.90 | ACHE (0.44) | MEN1KMT2AALOX5APCYP3A4ALOX5 | |
| SCHEMBL2007874 | 0.89 | FAAH (0.41) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2010143 | 0.89 | PTGES2 (0.42) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2006280 | 0.89 | FAAH (0.44) | FAAHMCL1MEN1HTTKMT2A | |
| SCHEMBL1999807 | 0.89 | ALOX5AP (0.42) | ALOX5APPTGS1CYP3A4ALOX5CYP2C9 | |
| SCHEMBL2002574 | 0.89 | FAAH (0.42) | FAAHMCL1MEN1HTTKMT2A |
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 |