Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 15/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.54 |
| ▸ | PARP1 | P09874 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL19747503 | 1.00 | AR (0.71) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL29655150 | 0.85 | AR (0.68) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL19748393 | 0.85 | AR (0.68) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL12955359 | 0.83 | AR (1.00) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL19748634 | 0.81 | AR (0.73) | ARLMNAHTTNPSR1PARP1 | |
| SCHEMBL29655186 | 0.81 | AR (0.73) | ARLMNAHTTNPSR1PARP1 | |
| SCHEMBL29007080 | 0.81 | AR (0.66) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL19747941 | 0.80 | AR (0.64) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL28812947 | 0.80 | AR (0.76) | ARLMNAHTTNPSR1ENPP1 | |
| SCHEMBL4572876 | 0.79 | PARP1 (0.72) | ARLMNAENPP1PARP1 |
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-109843874-B | Phthalazine derivatives useful as inhibitors of PARP1, PARP2 and/or tubulin for the treatment of cancer | 加利福尼亚大学董事会 | 2022-05-27 | — | — | CN | disclosed |