Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.62 |
| ▸ | TRPV1 | Q8NER1 | 16/20 | 0.56 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | CA2 | P00918 | 3/20 | 0.56 |
| ▸ | CA7 | P43166 | 3/20 | 0.56 |
| ▸ | CA9 | Q16790 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28416007 | 1.00 | KDR (0.62) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL28425517 | 0.92 | KDR (0.64) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL28425515 | 0.92 | KDR (0.64) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL30681190 | 0.89 | KDR (0.68) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL30681148 | 0.89 | KDR (0.68) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL29145796 | 0.84 | KDR (0.62) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL28423910 | 0.84 | KDR (0.62) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL30681201 | 0.84 | KDR (0.62) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL28423905 | 0.84 | TRPV1 (0.59) | KDRTRPV1 | |
| SCHEMBL28425513 | 0.83 | KDR (0.61) | KDRTRPV1CA1CA2CA7 |
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-111217722-B | Azo aryl urea derivative, and preparation method and application thereof | 华东理工大学 | 2024-01-02 | — | — | CN | disclosed |
| CN-111217722-A | Azo aryl urea derivative and preparation method and application thereof | 华东理工大学 | 2020-06-02 | — | — | CN | disclosed |