Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28683771 | 0.84 | CYP4F2 (0.38) | CYP4F2CYP4A11MAPK1MEN1KMT2A | |
| SCHEMBL6629252 | 0.83 | CYP4F2 (0.61) | CYP4F2CYP4A11MAPK1MEN1KMT2A | |
| SCHEMBL13888775 | 0.82 | CYP4F2 (0.44) | CYP4F2CYP4A11CYP3A4CYP2C9PKM | |
| SCHEMBL14858868 | 0.81 | CYP4F2 (0.59) | CYP4F2CYP4A11MAPK1MEN1KMT2A | |
| SCHEMBL14857809 | 0.81 | CYP4F2 (0.59) | CYP4F2CYP4A11MAPK1MEN1KMT2A | |
| SCHEMBL3881240 | 0.81 | CYP3A4 (0.39) | CYP4F2CYP4A11L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL14857995 | 0.81 | CYP4F2 (0.59) | CYP4F2CYP4A11MAPK1MEN1KMT2A | |
| SCHEMBL25742466 | 0.81 | CYP4F2 (0.50) | CYP4F2CYP4A11MAPTCYP3A4CYP2C9 | |
| SCHEMBL2028459 | 0.79 | CYP4F2 (0.43) | CYP4F2CYP4A11L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL16508916 | 0.79 | CYP3A4 (0.40) | CYP4F2CYP4A11MEN1KMT2ACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116406272-A | DNA-PK selective inhibitor and preparation method and application thereof | 首药控股(北京)股份有限公司 | 2023-07-07 | — | — | CN | disclosed |
| WO-2022017368-A1 | DNA-PK SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 首药控股(北京)股份有限公司 | 2022-01-27 | — | — | WO | disclosed |
| CN-113956272-A | DNA-PK selective inhibitor and preparation method and application thereof | 首药控股(北京)有限公司 | 2022-01-21 | — | — | CN | disclosed |