Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 2/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | LITAF | Q99732 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30349839 | 0.84 | PIK3CA (0.48) | PRKDCPIK3CAMTORMAPTPOLB | |
| SCHEMBL25407883 | 0.83 | TDP1 (0.46) | TDP1MEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL30349810 | 0.83 | CYP1A2 (0.48) | PRKDCPIK3CAMTORMEN1KMT2A | |
| SCHEMBL25406820 | 0.82 | MAPT (0.42) | TDP1MEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL30349918 | 0.80 | CYP1A2 (0.47) | TDP1MEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL25436149 | 0.80 | PRKDC (0.38) | PRKDCPIK3CAMTORTNFLITAF | |
| SCHEMBL30349870 | 0.80 | PRKDC (0.38) | PRKDCPIK3CAMTORTNFLITAF | |
| SCHEMBL25437146 | 0.79 | MEN1 (0.48) | PRKDCPIK3CATDP1MTORMEN1 | |
| SCHEMBL30349764 | 0.78 | MAPT (0.42) | TDP1MEN1KMT2AMAPTCYP1A2 | |
| SCHEMBL30349814 | 0.75 | CYP1A2 (0.50) | TDP1MEN1KMT2AMAPTCYP1A2 |
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-115867277-A | Novel fused heterocyclyl-carbohydrazone acyldinitrile compounds and use thereof | 韩国科学技术研究院 | 2023-03-28 | — | — | CN | disclosed |