Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.47 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28118860 | 0.84 | LIMK2 (0.48) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL18040300 | 0.71 | ALDH3A1 (0.48) | MAPTHTTLMNASMN1; SMN2GAA | |
| SCHEMBL5321444 | 0.70 | ESR1 (0.62) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL15570219 | 0.69 | CYP3A4 (0.50) | CA12CA1CA2CA9LMNA | |
| SCHEMBL28039002 | 0.68 | ESR1 (0.64) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL27452733 | 0.68 | ESR1 (0.63) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL2793396 | 0.68 | ESR1 (0.58) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL7095574 | 0.68 | ESR1 (0.68) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL27850097 | 0.68 | ESR1 (0.58) | ESR1LIMK2PLAACA12CA1 | |
| SCHEMBL27364900 | 0.68 | ESR1 (0.58) | ESR1LIMK2PLAACA12CA1 |
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-106279159-B | 2 phenyl 3 (tosyl methyl) imidazo [1,2 a] pyridine compounds and theirs and its synthetic method | 郑州大学 | 2017-08-25 | — | — | CN | disclosed |
| CN-106279159-A | 2 phenyl 3 (tosyl methyl) imidazo [1,2 a] pyridine compounds and their and synthetic methods thereof | 郑州大学 | 2017-01-04 | — | — | CN | disclosed |