Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 6/20 | 0.54 |
| ▸ | CCKBR | P32239 | 4/20 | 0.54 |
| ▸ | CCKAR | P32238 | 2/20 | 0.51 |
| ▸ | CTSL | P07711 | 2/20 | 0.50 |
| ▸ | CTSS | P25774 | 2/20 | 0.50 |
| ▸ | CTSK | P43235 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | GHSR | Q92847 | 1/20 | 0.49 |
| ▸ | IL23R | Q5VWK5 | 1/20 | 0.49 |
| ▸ | NTSR2 | O95665 | 1/20 | 0.49 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.49 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.49 |
| ▸ | CTSH | P09668 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12877541 | 1.00 | CXCR4 (0.54) | CXCR4CCKBRCCKARCTSLCTSS | |
| SCHEMBL12890868 | 0.90 | CCKAR (0.59) | CXCR4CCKBRCCKARIL23R | |
| SCHEMBL13880088 | 0.84 | MC4R (0.54) | CXCR4IL23RNTSR2NTSR1SORT1 | |
| SCHEMBL12890384 | 0.83 | CCKBR (0.52) | CXCR4CCKBRCCKARCTSLCTSS | |
| SCHEMBL12877552 | 0.83 | CCKBR (0.52) | CXCR4CCKBRCCKARCTSLCTSS | |
| SCHEMBL30497472 | 0.83 | CXCR4 (0.55) | CXCR4CCKBRCCKAROPRM1NTSR2 | |
| SCHEMBL29532761 | 0.82 | CCKBR (0.60) | CXCR4CCKBRCCKAROPRM1GHSR | |
| SCHEMBL8355463 | 0.82 | CXCR4 (0.55) | CXCR4CCKBRIL23RTACR1 | |
| SCHEMBL8355434 | 0.82 | CXCR4 (0.55) | CXCR4CCKBRIL23RTACR1 | |
| SCHEMBL30544197 | 0.81 | CXCR4 (0.55) | CXCR4CCKBROPRM1IL23RTACR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7893223-B2 | Multidentate AZA ligands able to complex metal ions and the use thereof in diagnostics and therapy | BRACCO IMAGING S.P.A. (IT) | 2011-02-22 | — | — | US | disclosed |