Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.32 |
| ▸ | PRKCG | P05129 | 1/20 | 0.32 |
| ▸ | PRKCB | P05771 | 1/20 | 0.32 |
| ▸ | PRKCH | P24723 | 1/20 | 0.32 |
| ▸ | PRKCI | P41743 | 1/20 | 0.32 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.32 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.32 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 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 | |
|---|---|---|---|---|
| SCHEMBL3442983 | 0.83 | MMP1 (0.41) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL8215989 | 0.83 | MMP1 (0.41) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL8216917 | 0.80 | MMP1 (0.42) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL12192460 | 0.79 | MMP1 (0.38) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL11552293 | 0.79 | MMP1 (0.35) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL11555153 | 0.79 | MMP1 (0.35) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL18908741 | 0.78 | MMP1 (0.37) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL2690771 | 0.77 | HTT (0.50) | CYP2C19MMP1MMP2MMP3MMP9 | |
| SCHEMBL3095915 | 0.76 | MMP1 (0.40) | MMP1MMP2MMP3MMP9MMP13 | |
| SCHEMBL24502636 | 0.76 | ALDH1A1 (0.38) | CYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105693504-A | Preparation method of gemfibrozil | 康普药业股份有限公司 | 2016-06-22 | — | — | CN | disclosed |