Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 6/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL2004340 | 0.94 | F2RL3 (0.37) | OPRK1F2RL3MAPTALOX5APKDM4E | |
| SCHEMBL2004659 | 0.93 | KDM4E (0.37) | OPRK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4544118 | 0.92 | OPRK1 (0.38) | PLA2G2AOPRK1ACHECYP1A2CYP3A4 | |
| SCHEMBL2001936 | 0.91 | OPRK1 (0.36) | OPRK1CYP1A2CYP2D6CYP2C9MAPT | |
| SCHEMBL2004726 | 0.91 | OPRK1 (0.42) | PLA2G2AOPRK1PTGS2ACHECYP1A2 | |
| SCHEMBL2005776 | 0.91 | PLA2G2A (0.37) | PLA2G2APTGS2F2RL3CYP1A2CYP3A4 | |
| SCHEMBL2008404 | 0.90 | L3MBTL1 (0.39) | OPRK1CYP1A2CYP2D6CYP2C9MAPT | |
| SCHEMBL1999938 | 0.90 | PLA2G2A (0.39) | PLA2G2AACHEPTGDR2MAPTGSK3B | |
| SCHEMBL2003477 | 0.90 | LMNA (0.40) | OPRK1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2003008 | 0.90 | PLA2G2A (0.40) | PLA2G2APTGS2F2RL3CYP1A2CYP3A4 |
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 |