Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7359412 | 0.90 | MTNR1B (0.35) | KDM4ECCR5ALDH1A1 | |
| Fumaric Acid SCHEMBL9149646 | 0.85 | CCR2 (0.39) | CCR2KCNH2MAPK1 | |
| Fumaric Acid SCHEMBL9149650 | 0.85 | CCR2 (0.39) | CCR2KCNH2MAPK1 | |
| SCHEMBL7322676 | 0.83 | KCNH2 (0.42) | CCR2KCNH2MAPK1TACR1 | |
| SCHEMBL7291776 | 0.79 | KCNH2 (0.47) | KCNH2MAPK1SLC29A1SMN1; SMN2 | |
| SCHEMBL7292958 | 0.77 | KCNH2 (0.38) | CCR2KCNH2 | |
| Fumaric Acid SCHEMBL7359414 | 0.74 | MTNR1B (0.39) | KDM4ECCR5ALDH1A1 | |
| SCHEMBL7294243 | 0.73 | SIGMAR1 (0.43) | — | |
| SCHEMBL7289973 | 0.72 | SLC6A3 (0.44) | — | |
| SCHEMBL7289109 | 0.71 | SIGMAR1 (0.39) | KCNH2 |
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-5238939-A | Isochromane derivatives | AKZO N.V. (NL) | 1993-08-24 | — | — | US | disclosed |