Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 4/20 | 0.38 |
| ▸ | DRD3 | P35462 | 4/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24672241 | 1.00 | HSD17B10 (0.63) | HSD17B10PIK3CDDRD2DRD3DRD4 | |
| SCHEMBL28902590 | 1.00 | HSD17B10 (0.63) | HSD17B10PIK3CDDRD2DRD3DRD4 | |
| SCHEMBL21814634 | 0.98 | HSD17B10 (0.61) | HSD17B10PIK3CDDRD2DRD3DRD4 | |
| SCHEMBL28368964 | 0.87 | HSD17B10 (0.50) | HSD17B10BRD4 | |
| SCHEMBL24672257 | 0.83 | KDM4E (0.56) | HSD17B10MEN1KMT2A | |
| SCHEMBL4912947 | 0.83 | HSD17B10 (0.57) | HSD17B10PIK3CD | |
| SCHEMBL13833151 | 0.82 | DRD2 (0.47) | PIK3CDDRD2DRD3DRD4SLC6A3 | |
| SCHEMBL17996818 | 0.82 | DRD2 (0.47) | PIK3CDDRD2DRD3DRD4SLC6A3 | |
| SCHEMBL5860445 | 0.82 | — | — | |
| SCHEMBL8860654 | 0.82 | DRD2 (0.47) | PIK3CDDRD2DRD3DRD4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022204065-A1 | IRON(III) MACROCYCLIC COMPLEXES WITH MIXED HYROXYL PENDANTS AS MRI CONTRAST AGENTS | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2022-09-29 | — | — | WO | disclosed |