Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29204674 | 1.00 | CYP3A4 (0.35) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL30884232 | 0.78 | CNR2 (0.31) | CYP3A4 | |
| SCHEMBL31554224 | 0.75 | DRD1 (0.36) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL20903826 | 0.69 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL4107487 | 0.68 | MAPT (0.40) | CYP3A4TDP1 | |
| SCHEMBL5935405 | 0.67 | ALDH1A1 (0.36) | CYP3A4 | |
| SCHEMBL150139 | 0.66 | TDP1 (0.69) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL30576395 | 0.65 | CYP3A4 (0.44) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL31554164 | 0.64 | GAA (0.31) | — | |
| SCHEMBL4146230 | 0.64 | CYP3A4 (0.65) | CYP3A4TDP1DRD1ESR1ESR2 |
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-119859216-A | Polar functionalized conjugated diene polymer and preparation method thereof | 东华大学 | 2025-04-22 | — | — | CN | disclosed |
| CN-117986304-A | Complex, catalyst system containing complex and use of catalyst system | 东华大学 | 2024-05-07 | — | — | CN | disclosed |