Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6740183 | 0.97 | ALDH1A1 (0.52) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL947101 | 0.86 | ALDH1A1 (0.53) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL9117075 | 0.75 | — | — | |
| SCHEMBL7943907 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL4422406 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL23085616 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL11773747 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL1966547 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL6456132 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 | |
| SCHEMBL31261818 | 0.73 | ALDH1A1 (0.48) | ALDH1A1NPSR1PAX8CTDSP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6686428-B2 | TRANSMETALLATION REAGENTS REACTED WITH ALPHA-HALOCARBONYL COMPOUNDS IN THE PRESENCE OF A METAL CATALYST | THE PENN STATE RESEARCH FOUNDATION | 2004-02-03 | — | — | US | disclosed |
| US-20020193543-A1 | Transmetallation reagents reacted with alpha-halocarbonyl compounds in the presence of a metal catalyst | NATIONAL INSTITUTES OF HEALTH | 2002-12-19 | — | — | US | disclosed |
| US-6291061-B1 | Hydrogen gettering packing material, and process for making same | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY | 2001-09-18 | — | — | US | disclosed |