Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.43 |
| ▸ | KDM1A | O60341 | 3/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16206200 | 0.88 | PTGS2 (0.49) | PTGS2HDAC1KCNH2HSP90AA1HSP90AB1 | |
| SCHEMBL16129974 | 0.85 | HDAC1 (0.45) | HDAC1KCNH2ALOX5HSP90AA1HSP90AB1 | |
| SCHEMBL2193198 | 0.84 | CYP19A1 (0.53) | KCNH2ALOX5HSP90AA1HSP90AB1SIGMAR1 | |
| SCHEMBL18922487 | 0.75 | KDM1A (0.43) | PTGS2HDAC1KCNH2HSP90AA1HSP90AB1 | |
| SCHEMBL14809691 | 0.74 | HDAC1 (0.49) | HDAC1KCNH2ALOX5 | |
| SCHEMBL16264805 | 0.73 | AR (0.42) | KCNH2ALOX5 | |
| SCHEMBL16206205 | 0.73 | NOTUM (0.73) | PTGS2HDAC1HSP90AB1KDM1ASIGMAR1 | |
| SCHEMBL18922489 | 0.73 | NOTUM (0.55) | PTGS2HDAC1HSP90AA1HSP90AB1KDM1A | |
| SCHEMBL18925014 | 0.73 | SIGMAR1 (0.45) | PTGS2HDAC1KCNH2KDM1ASIGMAR1 | |
| SCHEMBL20344482 | 0.73 | CA5A (0.63) | PTGS2HDAC1GRM2KDM1ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014172885-A1 | GROUP 9 TRANSITION METAL CATALYSTS AND PROCESS FOR USE OF SAME | GUANG MING INNOVATION COMPANY (WUHAN) (CN) | 2014-10-30 | — | — | WO | disclosed |