Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.52 |
| ▸ | MMP3 | P08254 | 4/20 | 0.52 |
| ▸ | CCNT1 | O60563 | 9/20 | 0.45 |
| ▸ | CDK9 | P50750 | 9/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14320646 | 0.81 | TDO2 (0.49) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL18409125 | 0.78 | CCNT1 (0.45) | CCNT1CDK9TDO2GPR119 | |
| SCHEMBL11956930 | 0.77 | LMNA (0.62) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL15174850 | 0.77 | QDPR (0.49) | MMP2MMP3L3MBTL1ALDH1A1 | |
| SCHEMBL979744 | 0.75 | THRB (0.49) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL979793 | 0.75 | QDPR (0.58) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL15615751 | 0.75 | CCNT1 (0.49) | CCNT1CDK9TDO2LMNATHRB | |
| SCHEMBL24721518 | 0.74 | MMP2 (0.56) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL6437476 | 0.74 | MMP2 (0.49) | MMP2MMP3CCNT1CDK9TDO2 | |
| SCHEMBL979623 | 0.73 | CCNT1 (0.49) | MMP2MMP3CCNT1CDK9TDO2 |
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-2017012647-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS | GALAPAGOS NV (BE) | 2017-01-26 | — | — | WO | disclosed |