Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 5/20 | 0.42 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | GRB2 | P62993 | 2/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGAV | P06756 | 1/20 | 0.34 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | ECE1 | P42892 | 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 | |
|---|---|---|---|---|
| SCHEMBL21715635 | 0.87 | MMP1 (0.39) | MMP1MMP2MMP3GRB2CTSB | |
| SCHEMBL13398330 | 0.70 | LNPEP (0.48) | — | |
| SCHEMBL13628884 | 0.70 | LNPEP (0.48) | — | |
| SCHEMBL7999700 | 0.70 | CA2 (0.43) | ITGB1EPHX1ITGB3ITGAVITGA5 | |
| SCHEMBL15315079 | 0.70 | CA2 (0.43) | ITGB1EPHX1ITGB3ITGAVITGA5 | |
| SCHEMBL24286177 | 0.70 | CA2 (0.43) | MMP1ITGB1EPHX1ITGB3ITGAV | |
| SCHEMBL1093903 | 0.70 | CA2 (0.52) | ITGB1ITGB3ITGA5MMESOAT1 | |
| SCHEMBL30404207 | 0.70 | CA2 (0.52) | ITGB1ITGB3ITGA5MMESOAT1 | |
| SCHEMBL1093901 | 0.70 | CA2 (0.52) | ITGB1ITGB3ITGA5MMESOAT1 | |
| SCHEMBL13979533 | 0.69 | MMP1 (0.50) | MMP1MMP2MMP3GRB2ITGB1 |
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-2020033317-A1 | PIPERAZINE-2,5-DIONES AS TGF-BETA INHIBITORS | SOUTHERN RESEARCH INSTITUTE (US) | 2020-02-13 | — | — | WO | disclosed |