Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPPL2A | Q8TCT8 | 1/20 | 0.60 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | PTGES | O14684 | 1/20 | 0.49 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.49 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28628356 | 1.00 | SPPL2A (0.60) | SPPL2AKEAP1PTGESTAS2R14TAS2R8 | |
| SCHEMBL28628359 | 1.00 | SPPL2A (0.60) | SPPL2AKEAP1PTGESTAS2R14TAS2R8 | |
| SCHEMBL28738327 | 1.00 | SPPL2A (0.60) | SPPL2AKEAP1PTGESTAS2R14TAS2R8 | |
| SCHEMBL7905239 | 0.94 | SPPL2A (0.69) | SPPL2A | |
| SCHEMBL1058690 | 0.94 | SPPL2A (0.69) | SPPL2A | |
| SCHEMBL14602719 | 0.94 | SPPL2A (0.69) | SPPL2A | |
| SCHEMBL28610517 | 0.88 | SPPL2A (0.64) | SPPL2ATAS2R14 | |
| SCHEMBL15355882 | 0.88 | SPPL2A (0.61) | SPPL2A | |
| SCHEMBL28610516 | 0.88 | SPPL2A (0.64) | SPPL2ATAS2R14 | |
| SCHEMBL13174129 | 0.87 | SPPL2A (0.61) | SPPL2AKEAP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113277991-B | Nitrogen heterocyclic ring amino derivative, preparation method thereof and anti-HIV-1 drug | 中国医学科学院医药生物技术研究所 | 2022-07-12 | — | — | CN | disclosed |
| CN-114230630-A | Triptolide derivative and application thereof | 郑州人民医院(郑州人民医院医疗管理中心) | 2022-03-25 | — | — | CN | disclosed |
| CN-113277991-A | Nitrogen heterocyclic ring amino derivative, preparation method thereof and anti-HIV-1 drug | 中国医学科学院医药生物技术研究所 | 2021-08-20 | — | — | CN | disclosed |