Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 15/20 | 0.47 |
| ▸ | ADAM17 | P78536 | 15/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.44 |
| ▸ | MMP3 | P08254 | 2/20 | 0.44 |
| ▸ | MMP13 | P45452 | 2/20 | 0.44 |
| ▸ | MMP7 | P09237 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21035010 | 1.00 | MMP1 (0.47) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21034979 | 0.91 | MMP1 (0.45) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21034981 | 0.91 | MMP1 (0.45) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21035533 | 0.89 | CASP3 (0.56) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21034994 | 0.87 | ITGB1 (0.47) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21034999 | 0.87 | ITGB1 (0.47) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21034937 | 0.87 | ITGB1 (0.47) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21035402 | 0.85 | MMP1 (0.43) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21035318 | 0.85 | MMP1 (0.43) | MMP1ADAM17CASP3HCRTR1HCRTR2 | |
| SCHEMBL21035678 | 0.85 | ITGB1 (0.45) | MMP1ADAM17CASP3HCRTR1HCRTR2 |
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 |