Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14829642 | 0.77 | CYP3A4 (0.55) | CYP19A1TBXAS1 | |
| SCHEMBL28946577 | 0.77 | TBXAS1 (0.46) | CYP19A1TBXAS1MEN1KMT2A | |
| SCHEMBL6092843 | 0.76 | SOD1 (0.54) | — | |
| SCHEMBL9849597 | 0.74 | SOD1 (0.48) | CYP19A1 | |
| SCHEMBL28802966 | 0.73 | TBXAS1 (0.47) | CYP19A1TBXAS1HMOX1PRKCI | |
| SCHEMBL9849430 | 0.73 | TSHR (0.50) | CYP19A1TBXAS1 | |
| SCHEMBL11006343 | 0.73 | KMT2A (0.48) | CYP19A1TBXAS1MEN1KMT2APRKCI | |
| SCHEMBL5655551 | 0.72 | CYP19A1 (0.71) | CYP19A1TBXAS1KMT2AHMOX1 | |
| SCHEMBL7115452 | 0.71 | TBXAS1 (0.51) | CYP19A1TBXAS1MEN1KMT2AHMOX1 | |
| SCHEMBL3160306 | 0.71 | CYP19A1 (0.71) | CYP19A1TBXAS1HMOX1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805334-B | QC and GSK-3 beta multi-targeting inhibitor and preparation method and application thereof | 深圳大学 | 2023-06-09 | — | — | CN | disclosed |
| CN-114805334-A | QC and GSK-3 beta multi-target inhibitor and preparation method and application thereof | 深圳大学 | 2022-07-29 | — | — | CN | disclosed |