Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12269731 | 0.95 | CYP3A4 (0.43) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927990 | 0.95 | CYP3A4 (0.43) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL23837954 | 0.95 | CYP3A4 (0.43) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9928023 | 0.95 | CYP3A4 (0.43) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927995 | 0.95 | CYP3A4 (0.43) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL23837952 | 0.94 | CYP3A4 (0.42) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927978 | 0.90 | CYP3A4 (0.45) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927996 | 0.90 | CYP3A4 (0.45) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927972 | 0.90 | CYP3A4 (0.45) | CYP3A4MMP9MMP8MMP14USP2 | |
| SCHEMBL9927968 | 0.90 | CYP3A4 (0.45) | CYP3A4MMP9MMP8MMP14USP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9487408-B2 | Reducing aluminosilicate scale in the bayer process | NALCO COMPANY (US) | 2016-11-08 | — | — | US | disclosed |
| US-20120148462-A1 | REDUCING ALUMINOSILICATE SCALE IN THE BAYER PROCESS | ECOLAB USA INC. | 2012-06-14 | — | — | US | disclosed |