Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL11401676 | 0.87 | PTGS2 (0.63) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11397123 | 0.86 | PTGS2 (0.50) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL4734664 | 0.82 | CYP17A1 (0.39) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11343598 | 0.80 | MEN1 (0.68) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11342050 | 0.80 | ALDH1A1 (0.46) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11759198 | 0.80 | ALDH1A1 (0.56) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11346578 | 0.79 | MAPK14 (0.43) | HPGDKMT2AALDH1A1MEN1LMNA | |
| SCHEMBL11395551 | 0.78 | PTGS2 (0.71) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11759541 | 0.77 | HPGD (0.63) | PTGS2OPRK1PDE4DHPGDKMT2A | |
| SCHEMBL11394759 | 0.77 | PTGS2 (0.57) | PTGS2OPRK1PDE4DHPGDKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008061029-A1 | ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE | WYETH (US) | 2008-05-22 | — | — | WO | disclosed |
| US-4243805-A | 3 Fluoro-10-piperazino-8-substituted 10,11-dihydrodibenzo-(bf) thiepins and method for the preparation thereof | SPOFA, SPOJENE PODNIKY PRO ZDRAVOTNICKOU VYROBU (CS) | 1981-01-06 | — | — | US | disclosed |