Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL14706743 | 0.79 | AR (0.42) | ARPARP1LOXL2HCRTR1HCRTR2 | |
| SCHEMBL29874076 | 0.76 | AR (0.37) | ARPARP1LOXL2HCRTR1HCRTR2 | |
| SCHEMBL29979743 | 0.74 | LOXL2 (0.41) | LOXL2 | |
| SCHEMBL648113 | 0.74 | — | — | |
| SCHEMBL1166695 | 0.74 | LOX (0.34) | ARPARP1LOXL2HCRTR1HCRTR2 | |
| SCHEMBL29183405 | 0.73 | AR (0.33) | ARPARP1LOXL2LOX | |
| SCHEMBL29183400 | 0.73 | AR (0.33) | ARPARP1LOXL2LOX | |
| SCHEMBL30792294 | 0.71 | AR (0.48) | ARPARP1LOXL2LOX | |
| SCHEMBL31658780 | 0.71 | AR (0.34) | ARPARP1LOXL2HCRTR1HCRTR2 | |
| SCHEMBL1639940 | 0.71 | — | — |
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-117659020-A | Imidazo [1,2-b ] pyridazine derivative, and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-03-08 | — | — | CN | disclosed |