Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PTGES2 | Q9H7Z7 | 6/20 | 0.39 |
| ▸ | PTGES | O14684 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | MDM4 | O15151 | 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 | |
|---|---|---|---|---|
| SCHEMBL2002832 | 0.94 | S1PR3 (0.40) | MAPTPPARGTP53MEN1KMT2A | |
| SCHEMBL2006486 | 0.93 | PTGES2 (0.41) | PPARGMEN1KMT2APTGES2PTGES | |
| SCHEMBL2002572 | 0.92 | HSD17B10 (0.36) | MAPTPPARGTP53MEN1CYP3A4 | |
| SCHEMBL2004953 | 0.91 | PLA2G2A (0.45) | MAPTMEN1CYP3A4TSHRKMT2A | |
| SCHEMBL2004983 | 0.91 | PTGES2 (0.42) | MAPTPPARGTP53MEN1CYP3A4 | |
| SCHEMBL2008218 | 0.90 | ALOX5AP (0.41) | CYP3A4 | |
| SCHEMBL1999518 | 0.88 | MAPT (0.43) | MAPTPPARGTP53MEN1CYP3A4 | |
| SCHEMBL2006154 | 0.87 | DRD2 (0.37) | MAPTMEN1CYP3A4KMT2APTGES2 | |
| SCHEMBL2002922 | 0.86 | MAPT (0.35) | MAPTPPARGMEN1ALOX15TSHR | |
| SCHEMBL2006095 | 0.85 | FAAH (0.39) | MAPTMEN1CYP3A4TSHRKMT2A |
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 |