Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | WEE1 | P30291 | 11/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | RGS12 | O14924 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30730457 | 0.86 | PARP1 (0.59) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL28206411 | 0.86 | PARP1 (0.59) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL29586402 | 0.86 | PARP1 (0.59) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL27945930 | 0.85 | PARP1 (0.54) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL28228756 | 0.85 | PARP1 (0.54) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL2894929 | 0.82 | ALDH1A1 (0.46) | PARP1WEE1CHEK1MEN1KMT2A | |
| SCHEMBL28839594 | 0.81 | PARP1 (0.49) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL4101252 | 0.81 | PARP1 (0.56) | PARP1NPSR1WEE1CHEK1MEN1 | |
| SCHEMBL28240847 | 0.80 | ALDH1A1 (0.50) | MEN1KMT2APOLBCYP3A4MAPT | |
| SCHEMBL1756367 | 0.80 | PARP1 (0.63) | PARP1NPSR1MEN1KMT2ATDP1 |
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-111620819-B | Separation and purification method and application of two compounds in musa basjoo root | 贵州医科大学 | 2022-05-13 | — | — | CN | disclosed |