Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 4/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | FER | P16591 | 1/20 | 0.48 |
| ▸ | LTK | P29376 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.48 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.48 |
| ▸ | TSPO | P30536 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23022773 | 0.75 | PDGFRA (0.52) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL23022764 | 0.75 | ACVR1 (0.52) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL7852676 | 0.75 | CHEK1 (0.54) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL9198762 | 0.70 | GAA (0.72) | TSPOSMN1; SMN2RAB9A | |
| SCHEMBL9596865 | 0.70 | RAB9A (0.53) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL1366906 | 0.70 | PDGFRA (0.46) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL2420711 | 0.70 | LRRK2 (0.90) | LRRK2PDGFRAFERLTKCDK8 | |
| SCHEMBL366728 | 0.70 | — | — | |
| SCHEMBL24132907 | 0.68 | CES1 (0.53) | MAOAMAOB | |
| SCHEMBL5879647 | 0.68 | TSPO (0.67) | 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 |
|---|---|---|---|---|---|---|---|
| US-5321023-A | Pyridoindolobenzodiazepines and derivatives as antipsychotics | THE DU PONT MERCK PHARMACEUTICAL CO. (US) | 1994-06-14 | — | — | US | disclosed |
| US-4438120-A | Pyridoindolobenzodiazepine tranquilizers | E. I. DU PONT DE NEMOURS & COMPANY (US) | 1984-03-20 | — | — | US | disclosed |