Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.34 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15062457 | 0.82 | PTGS2 (0.42) | PTGS1PTGS2MEN1KMT2AKDM4E | |
| SCHEMBL2005652 | 0.81 | PTGS2 (0.47) | PTGS1PTGS2MEN1KMT2AKDM4E | |
| SCHEMBL2001687 | 0.80 | PTGS1 (0.48) | PTGS1PTGS2MEN1KMT2AKDM4E | |
| SCHEMBL2002091 | 0.78 | PTGS1 (0.48) | PTGS1PTGS2MEN1KMT2AKDM4E | |
| SCHEMBL6426550 | 0.77 | PTGS2 (0.44) | PTGS1PTGS2 | |
| SCHEMBL2002678 | 0.77 | AKR1C3 (0.47) | PTGS1PTGS2 | |
| SCHEMBL6425616 | 0.75 | PTGS2 (0.54) | PTGS1PTGS2MEN1KMT2AKDM4E | |
| SCHEMBL6424402 | 0.75 | LMNA (0.37) | PTGS1PTGS2KMT2A | |
| SCHEMBL6426710 | 0.75 | PTGS2 (0.42) | PTGS1PTGS2 | |
| SCHEMBL15062458 | 0.75 | PTGS2 (0.38) | PTGS1PTGS2 |
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 |