Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 4/20 | 0.42 |
| ▸ | MMP1 | P03956 | 5/20 | 0.41 |
| ▸ | MMP3 | P08254 | 5/20 | 0.41 |
| ▸ | MMP7 | P09237 | 4/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.36 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.36 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21036273 | 1.00 | MMP9 (0.42) | MMP9MMP1MMP3MMP7PDE4A | |
| SCHEMBL21036271 | 0.92 | MMP9 (0.42) | MMP9MMP1MMP3MMP7PDE4A | |
| SCHEMBL21035522 | 0.90 | MMP1 (0.43) | MMP9MMP1MMP3MMP7PDE4A | |
| SCHEMBL21035654 | 0.86 | HCRTR1 (0.41) | MMP9MMP1MMP3MMP7MMP2 | |
| SCHEMBL21034982 | 0.86 | HCRTR1 (0.41) | MMP9MMP1MMP3MMP7MMP2 | |
| SCHEMBL21034977 | 0.86 | CA12 (0.46) | MMP9MMP1MMP3MMP7MMP2 | |
| SCHEMBL21035352 | 0.86 | CA12 (0.46) | MMP9MMP1MMP3MMP7MMP2 | |
| SCHEMBL21035398 | 0.86 | HTR1A (0.42) | MMP9MMP1MMP3PDE4BHCRTR1 | |
| SCHEMBL21035317 | 0.86 | HTR1A (0.42) | MMP9MMP1MMP3PDE4BHCRTR1 | |
| SCHEMBL21035318 | 0.84 | MMP1 (0.43) | MMP9MMP1MMP3MMP7MMP2 |
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-2019104011-A1 | CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE | BIOMARIN PHARMACEUTICAL INC. (US) | 2019-05-31 | — | — | WO | disclosed |