Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TDP2 | O95551 | 2/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.40 |
| ▸ | PARG | Q86W56 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | STAT6 | P42226 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1049959 | 0.76 | NPSR1 (0.58) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL17529466 | 0.76 | PARP1 (0.61) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL17529461 | 0.76 | NPSR1 (0.54) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL17529459 | 0.75 | MEN1 (0.57) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL17529456 | 0.75 | NPSR1 (0.56) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL1049963 | 0.72 | PARP1 (0.56) | NPSR1PARP1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28914061 | 0.72 | PARP1 (0.47) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL17529458 | 0.72 | NPSR1 (0.52) | NPSR1PARP1MEN1KMT2APKM | |
| SCHEMBL2653721 | 0.71 | TDP1 (0.49) | MEN1KMT2ATDP2CHEK1ALDH1A1 | |
| SCHEMBL4612017 | 0.71 | PARP1 (0.53) | NPSR1PARP1MEN1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016028225-A1 | PLATINUM COMPLEXES AS ANTICANCER AGENTS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2016-02-25 | — | — | WO | disclosed |