Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 16/20 | 0.68 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | PARP1 | P09874 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL19748393 | 1.00 | AR (0.68) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL19747590 | 0.87 | AR (0.65) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL29655014 | 0.87 | AR (0.65) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL29655109 | 0.85 | AR (0.71) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL19747503 | 0.85 | AR (0.71) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL29655072 | 0.85 | AR (0.66) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL21528308 | 0.85 | AR (0.66) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL28812947 | 0.83 | AR (0.76) | ARENPP1LMNAHTTNPSR1 | |
| SCHEMBL29483966 | 0.83 | PARP1 (0.72) | ARENPP1LMNAPARP1 | |
| SCHEMBL4572876 | 0.83 | PARP1 (0.72) | ARENPP1LMNAPARP1 |
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 |