Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 3/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29655190 | 0.84 | BACE1 (0.53) | MEN1KMT2ATDP1PGRBACE1 | |
| SCHEMBL29655115 | 0.84 | BACE1 (0.53) | MEN1KMT2ATDP1PGRBACE1 | |
| SCHEMBL5952352 | 0.84 | BACE1 (0.53) | MEN1KMT2ATDP1PGRBACE1 | |
| SCHEMBL26832646 | 0.84 | ALDH1A1 (0.50) | MEN1KMT2APGRBACE1APP | |
| SCHEMBL5843815 | 0.84 | CYP3A4 (0.53) | MEN1KMT2APGRBACE1APP | |
| Ammonia Solution, Strong SCHEMBL5953223 | 0.82 | BACE1 (0.51) | MEN1KMT2ATDP1PGRBACE1 | |
| SCHEMBL27787920 | 0.82 | TDP1 (0.50) | MEN1KMT2ATDP1KCNH2ALOX5AP | |
| SCHEMBL13263254 | 0.79 | WDR5 (0.47) | PGRBACE1APPDYRK1APIM1 | |
| SCHEMBL19452779 | 0.78 | PGR (0.44) | PGRBACE1APPDYRK1AALOX5AP | |
| SCHEMBL20486024 | 0.78 | TAAR1 (0.45) | TDP1PGRBACE1APPDYRK1A |
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 |