Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 3/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | ALAD | P13716 | 2/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | QDPR | P09417 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PRKACA | P17612 | 1/20 | 0.30 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.30 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.30 |
| ▸ | CYP21A2 | P08686 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6880201 | 1.00 | MMP12 (0.39) | MMP12MMP13MMP3MMP9MMP8 | |
| SCHEMBL6851843 | 1.00 | MMP12 (0.39) | MMP12MMP13MMP3MMP9MMP8 | |
| SCHEMBL6870780 | 0.84 | DYRK1A (0.51) | ERN1CYP3A4 | |
| SCHEMBL6870789 | 0.84 | DYRK1A (0.51) | ERN1CYP3A4 | |
| SCHEMBL6870784 | 0.84 | DYRK1A (0.51) | ERN1CYP3A4 | |
| SCHEMBL6851970 | 0.83 | CYP3A4 (0.37) | CYP3A4PRKACAROCK1 | |
| SCHEMBL6851975 | 0.83 | CYP3A4 (0.37) | CYP3A4PRKACAROCK1 | |
| SCHEMBL6852674 | 0.83 | ERN1 (0.31) | ALADERN1 | |
| SCHEMBL6852667 | 0.83 | ERN1 (0.31) | ALADERN1 | |
| SCHEMBL6852666 | 0.83 | ERN1 (0.31) | ALADERN1 |
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-6825170-B2 | ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2004-11-30 | — | — | US | disclosed |