Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 13/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 8/20 | 0.42 |
| ▸ | CTSL | P07711 | 3/20 | 0.40 |
| ▸ | CTSB | P07858 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17282840 | 1.00 | CYP2D6 (0.48) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL15627223 | 1.00 | CYP2D6 (0.48) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL23314770 | 0.84 | CTSK (0.47) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL15629776 | 0.84 | CTSK (0.61) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL6381798 | 0.84 | CTSK (0.52) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL30993196 | 0.81 | CA1 (0.49) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL30993172 | 0.81 | CA1 (0.49) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL31606449 | 0.80 | CYP2D6 (0.53) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL13538162 | 0.80 | CYP2D6 (0.53) | CYP2D6CTSKCA1CA2CA7 | |
| SCHEMBL14931110 | 0.80 | CYP2D6 (0.53) | CYP2D6CTSKCA1CA2CA7 |
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-106661084-B | Macrocyclic broad spectrum antibiotics | 阿奇克斯制药公司 | 2021-08-31 | — | — | CN | disclosed |