Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.74 |
| ▸ | TRPV1 | Q8NER1 | 16/20 | 0.73 |
| ▸ | CA1 | P00915 | 2/20 | 0.61 |
| ▸ | CA2 | P00918 | 2/20 | 0.61 |
| ▸ | CA7 | P43166 | 2/20 | 0.61 |
| ▸ | CA9 | Q16790 | 2/20 | 0.61 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL12320168 | 0.90 | KDR (0.70) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL281864 | 0.88 | KDR (0.85) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL21751021 | 0.87 | KDR (0.74) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL29364392 | 0.86 | KDR (1.00) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL118026 | 0.86 | KDR (1.00) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL26697260 | 0.84 | CA12 (0.64) | KDRTRPV1CA1CA2CA9 | |
| SCHEMBL6586394 | 0.84 | TRPV1 (0.69) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL6583065 | 0.82 | TRPV1 (1.00) | TRPV1 | |
| SCHEMBL9084296 | 0.82 | KDR (0.85) | KDRTRPV1CA1CA2CA7 | |
| SCHEMBL28239876 | 0.82 | TRPV1 (0.71) | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114920703-B | Quinazoline derivative and preparation method and application thereof | 天津济坤医药科技有限公司 | 2024-01-09 | — | — | CN | disclosed |
| WO-2023226323-A1 | QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 天津济坤医药科技有限公司 | 2023-11-30 | — | — | WO | disclosed |
| WO-2023226323-A1 | QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 天津济坤医药科技有限公司 | 2023-11-30 | — | — | WO | disclosed |
| CN-114920703-A | Quinazoline derivative and preparation method and application thereof | 天津济坤医药科技有限公司 | 2022-08-19 | — | — | CN | disclosed |
| CN-108530455-B | Urea substituted aromatic ring connecting dioxane and quinazoline compound or medicinal salt or hydrate and application as tyrosine kinase inhibitor | 北京赛特明强医药科技有限公司 | 2021-01-12 | — | — | CN | disclosed |