Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.62 |
| ▸ | CA1 | P00915 | 6/20 | 0.62 |
| ▸ | CA12 | O43570 | 6/20 | 0.62 |
| ▸ | CA9 | Q16790 | 6/20 | 0.62 |
| ▸ | CA3 | P07451 | 1/20 | 0.62 |
| ▸ | CA4 | P22748 | 1/20 | 0.62 |
| ▸ | CA6 | P23280 | 1/20 | 0.62 |
| ▸ | CA5A | P35218 | 1/20 | 0.62 |
| ▸ | CA7 | P43166 | 1/20 | 0.62 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.62 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.62 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.62 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL27714501 | 0.83 | CA2 (0.52) | CA2CA1CA12CA9CA3 | |
| SCHEMBL27723049 | 0.83 | CA2 (0.52) | CA2CA1CA12CA9CA3 | |
| (Z)-1,2-Diphenylethene SCHEMBL28205397 | 0.79 | MAOB (0.52) | LMNAPTGS2PTGS1MAPTSMN1; SMN2 | |
| SCHEMBL7297451 | 0.78 | CA2 (0.50) | CA2CA1CA12CA9CA3 | |
| SCHEMBL28748742 | 0.78 | TSHR (0.62) | LMNAPTGS2PTGS1MAPTSMN1; SMN2 | |
| SCHEMBL11741660 | 0.78 | NFE2L2 (0.46) | LMNAPTGS2CYP19A1MAOAMAOB | |
| SCHEMBL27525349 | 0.78 | CA2 (0.52) | CA2CA1CA12CA9CA3 | |
| SCHEMBL13720250 | 0.78 | CA2 (0.52) | CA2CA1CA12CA9CA3 | |
| SCHEMBL7297449 | 0.78 | CA2 (0.50) | CA2CA1CA12CA9CA3 | |
| SCHEMBL19479299 | 0.78 | CA2 (1.00) | CA2CA1CA12CA9CA3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106967055-B | A kind of preparation method of polysubstituted isoindoline | 中国科学院化学研究所 | 2019-08-13 | — | — | CN | disclosed |
| CN-110066231-A | A kind of azepine β-substitution Morita-Baylis-Hillman type compound and its synthetic method | 江苏师范大学 | 2019-07-30 | — | — | CN | disclosed |
| CN-110066231-A | A kind of azepine β-substitution Morita-Baylis-Hillman type compound and its synthetic method | 江苏师范大学 | 2019-07-30 | — | — | CN | disclosed |
| CN-107235886-A | The synthetic method of 2,3 pyrrolin rings | 合肥工业大学 | 2017-10-10 | — | — | CN | disclosed |
| CN-106967055-A | A kind of preparation method of polysubstituted isoindoline | 中国科学院化学研究所 | 2017-07-21 | — | — | CN | disclosed |
| CN-105384647-A | Triarylamine derivative, photoreceptor, and image forming apparatus | KYOCERA DOCUMENT SOLUTIONS INC | 2016-03-09 | — | — | CN | disclosed |
| CN-105294453-A | triarylamine derivative and electrophotographic photoreceptor | KYOCERA DOCUMENT SOLUTIONS INC | 2016-02-03 | — | — | CN | disclosed |