Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 5/20 | 0.43 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 10/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3599265 | 0.87 | PTGS2 (0.44) | CA9CA1CA2PTGS2PTGS1 | |
| SCHEMBL3615539 | 0.87 | PTGS2 (0.44) | CA9CA1CA2PTGS2PTGS1 | |
| SCHEMBL3612595 | 0.84 | CYP11B2 (0.44) | CA9CA1CA2CYP11B2 | |
| SCHEMBL3606471 | 0.84 | KHK (0.40) | CA9CA1CA2CYP11B2 | |
| SCHEMBL3608038 | 0.79 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL3602376 | 0.79 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL4558167 | 0.78 | KDM5A (0.45) | CA9PTGS2CA12CHRNA7 | |
| SCHEMBL8268988 | 0.75 | KHK (0.41) | — | |
| SCHEMBL8268992 | 0.75 | MAPK9 (0.36) | PTGS2 | |
| SCHEMBL3612178 | 0.73 | PTGS2 (0.39) | CA9CA1CA2PTGS2PTGS1 |
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-2009067607-A2 | COMBINATIONS OF PDE4 INHIBITORS AND ANTIPSYCHOTICS FOR THE TREATMENT OF PSYCHOTIC DISORDERS | MEMORY PHARMACEUTICALS CORPORATION (US) | 2009-05-28 | — | — | WO | disclosed |