Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL534932 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL1849381 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL27408880 | 0.86 | — | — | |
| Bromide SCHEMBL28311056 | 0.83 | — | — | |
| Pyridine SCHEMBL28074890 | 0.77 | TSHR (0.39) | LOXL2TSHR | |
| Heptane SCHEMBL28275701 | 0.75 | DNM1 (0.41) | TSHR | |
| Aniline SCHEMBL7770539 | 0.72 | TSHR (0.65) | TSHR | |
| Pyrrole SCHEMBL14562687 | 0.70 | CYP3A4 (0.67) | TSHR | |
| Benzidine SCHEMBL28723387 | 0.70 | CYP3A4 (0.61) | LOXL2TSHR | |
| Pyrrole SCHEMBL27347118 | 0.69 | — | — |
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-106220615-A | Pyrazoles aminopyridine derivative as LRRK2 regulator | 霍夫曼-拉罗奇有限公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-104271569-B | Pyrazolylaminopyrimidine derivatives as LRRK2 modulators | 霍夫曼-拉罗奇有限公司 | 2016-08-24 | — | — | CN | disclosed |