Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.72 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.72 |
| ▸ | FER | P16591 | 1/20 | 0.72 |
| ▸ | LTK | P29376 | 1/20 | 0.72 |
| ▸ | CDK8 | P49336 | 1/20 | 0.72 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.72 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.72 |
| ▸ | MAOA | P21397 | 1/20 | 0.59 |
| ▸ | MAOB | P27338 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | IDO1 | P14902 | 3/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TGM2 | P21980 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2420711 | 0.89 | LRRK2 (0.90) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL366728 | 0.89 | — | — | |
| Glycolic Acid SCHEMBL6888173 | 0.86 | LRRK2 (0.64) | LRRK2PDGFRAFERLTKCDK8 | |
| Isatin SCHEMBL13725994 | 0.85 | MAOA (0.83) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL28886187 | 0.84 | LRRK2 (0.75) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL1368292 | 0.84 | LRRK2 (1.00) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL27980501 | 0.84 | LRRK2 (0.82) | LRRK2PDGFRAFERLTKCDK8 | |
| Hydrochloric Acid SCHEMBL6299954 | 0.82 | LRRK2 (0.95) | LRRK2PDGFRAFERLTKCDK8 | |
| Phthalimide SCHEMBL15488735 | 0.81 | GSK3B (0.79) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL27425410 | 0.79 | LRRK2 (0.74) | LRRK2PDGFRAFERLTKCDK8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1238347-C | Heterocyclic derivatives | NIPPON SHINYAKU CO LTD (JP) | 2006-01-25 | — | — | CN | disclosed |
| CN-1430612-A | Hete rocyclic derivatives | NIPPON SHINYAKU CO LTD (JP) | 2003-07-16 | — | — | CN | disclosed |