Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.40 |
| ▸ | LSS | P48449 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.35 |
| ▸ | USP5 | P45974 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL578267 | 0.86 | QDPR (0.55) | QDPRBRD4SLC18A3LSSDRD2 | |
| SCHEMBL999428 | 0.79 | BRD4 (0.50) | QDPRBRD4LSSMDM2CYP3A4 | |
| SCHEMBL21815500 | 0.79 | BRD4 (0.50) | QDPRBRD4LSSMDM2CYP3A4 | |
| SCHEMBL21205779 | 0.76 | SLC18A3 (0.42) | QDPRBRD4SLC18A3DRD2CYP3A4 | |
| SCHEMBL31222996 | 0.75 | BRD4 (0.43) | QDPRBRD4SLC18A3LSSDRD2 | |
| SCHEMBL265495 | 0.75 | KDM1A (0.48) | BRD4CYP3A4CYP2C9SMN1; SMN2 | |
| SCHEMBL14804315 | 0.75 | KDM1A (0.48) | BRD4CYP3A4CYP2C9SMN1; SMN2 | |
| SCHEMBL3469385 | 0.74 | BRD4 (0.41) | QDPRBRD4SLC18A3DRD2CYP3A4 | |
| SCHEMBL13677031 | 0.74 | KCNH2 (0.49) | BRD4SLC18A3DRD2MDM2CYP3A4 | |
| SCHEMBL6249416 | 0.74 | DRD2 (0.53) | SLC18A3DRD2CYP3A4CYP2C9CYP2C19 |
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-116693518-A | Synthesis and application of EGFR inhibitor | 江南大学 | 2023-09-05 | — | — | CN | disclosed |