Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 2/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2002516 | 0.95 | L3MBTL1 (0.36) | PTGES2RETP2RX7TBXAS1ALDH1A1 | |
| SCHEMBL1999846 | 0.95 | LMNA (0.39) | PTGES2RETP2RX7ALDH1A1MAPT | |
| SCHEMBL2006372 | 0.95 | PTGES2 (0.39) | PTGES2RETP2RX7TBXAS1ALDH1A1 | |
| SCHEMBL2010168 | 0.93 | ALOX5AP (0.38) | PTGES2RETALDH1A1MAPTLMNA | |
| SCHEMBL2005003 | 0.93 | PTGES2 (0.43) | PTGES2RETTBXAS1ALDH1A1MAPT | |
| SCHEMBL2008130 | 0.92 | ALOX5AP (0.39) | PTGES2RETP2RX7ALDH1A1MAPT | |
| SCHEMBL2009968 | 0.92 | MAPT (0.39) | PTGES2ALDH1A1MAPTALOX12LMNA | |
| SCHEMBL2004748 | 0.91 | CYP3A4 (0.37) | ALDH1A1MAPTALOX12LMNANPSR1 | |
| SCHEMBL2003941 | 0.89 | P2RX7 (0.38) | PTGES2P2RX7TBXAS1ALDH1A1MAPT | |
| SCHEMBL1996469 | 0.88 | LMNA (0.42) | ALDH1A1MAPTALOX12LMNAHPGD |
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 |