Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL16543562 | 0.80 | HTT (0.34) | HTTKMT2A | |
| SCHEMBL20020427 | 0.77 | NOS3 (0.31) | — | |
| SCHEMBL8784605 | 0.77 | CCR1 (0.32) | — | |
| SCHEMBL15479688 | 0.73 | — | — | |
| SCHEMBL30774215 | 0.73 | HTT (0.36) | HTT | |
| SCHEMBL17675123 | 0.70 | NNMT (0.49) | — | |
| SCHEMBL30483673 | 0.69 | HTT (0.32) | HTTKMT2A | |
| SCHEMBL14303857 | 0.69 | DYRK1A (0.30) | — | |
| SCHEMBL29909946 | 0.68 | — | — | |
| SCHEMBL9538730 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105884752-A | Cyclic gyrase and topoisomerase IV inhibitor | 山东轩竹医药科技有限公司 | 2016-08-24 | — | — | CN | disclosed |