Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 8/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | CCR9 | P51686 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2004214 | 0.93 | CCR9 (0.37) | FAAHMEN1KMT2APTGES2ALOX5 | |
| SCHEMBL2001077 | 0.93 | PTGES2 (0.41) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2005859 | 0.91 | PTGES2 (0.44) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2002457 | 0.91 | ALOX5 (0.36) | PTGES2ALOX5ALOX5APCCR9MAPT | |
| SCHEMBL2002947 | 0.91 | CYP3A4 (0.35) | FAAHMAPTCYP2C9CYP3A4PTGDR2 | |
| SCHEMBL1998915 | 0.90 | LMNA (0.42) | FAAHMEN1KMT2AALOX5ALOX5AP | |
| SCHEMBL2006590 | 0.90 | FAAH (0.40) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2001753 | 0.89 | FAAH (0.44) | FAAHMEN1HTTKMT2APTGES2 | |
| SCHEMBL2001878 | 0.89 | ALOX5AP (0.42) | KMT2AALOX5ALOX5APMAPTCYP2C9 | |
| SCHEMBL2005283 | 0.88 | ALDH1A1 (0.38) | MEN1KMT2APTGES2CCR9CYP2C9 |
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 |