Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 5/20 | 0.39 |
| ▸ | NOS1 | P29475 | 5/20 | 0.39 |
| ▸ | NOS2 | P35228 | 5/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10972704 | 0.94 | CYP1A2 (0.46) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL10993645 | 0.92 | CYP1A2 (0.46) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL28287947 | 0.88 | CYP1A2 (0.38) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL128592 | 0.88 | — | — | |
| SCHEMBL11903821 | 0.87 | CYP1A2 (0.41) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL23227948 | 0.85 | CYP1A2 (0.62) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL11726232 | 0.85 | CYP1A2 (0.70) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL7741556 | 0.85 | CYP1A2 (0.70) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL97288 | 0.85 | CYP1A2 (0.70) | CYP1A2CA1CA2CA4NOS3 | |
| SCHEMBL3633846 | 0.85 | CYP1A2 (0.70) | CYP1A2CA1CA2CA4NOS3 |
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-114797970-B | Ethylene oligomerization modification auxiliary agent and homogeneous catalysis system thereof | 浙江大学 | 2023-07-18 | — | — | CN | disclosed |
| CN-114797970-A | Ethylene oligomerization modification auxiliary agent and homogeneous catalysis system thereof | 浙江大学 | 2022-07-29 | — | — | CN | disclosed |