Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BID | P55957 | 6/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 5/20 | 0.49 |
| ▸ | BAK1 | Q16611 | 5/20 | 0.49 |
| ▸ | KAT8 | Q9H7Z6 | 3/20 | 0.49 |
| ▸ | PPARA | Q07869 | 3/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.49 |
| ▸ | EP300 | Q09472 | 2/20 | 0.49 |
| ▸ | KAT5 | Q92993 | 2/20 | 0.49 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.49 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6566933 | 0.95 | BID (0.55) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL31146780 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL4443783 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL2048529 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL1052877 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL6565413 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL6567075 | 0.94 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL27925218 | 0.90 | BID (0.57) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL9360924 | 0.90 | BID (0.54) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL1063004 | 0.90 | BID (0.41) | BIDMCL1BCL2L1BAK1KAT8 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102746173-A | Emodin derivative and preparation method and application thereof | UNIV HENAN | 2012-10-24 | — | — | CN | claimed |
| EP-0854177-B1 | Ink compositions | XEROX CORP (US) | 2004-03-31 | — | — | EP | claimed |
| CN-111574474-B | Micromolecular compound for inhibiting iron death and preparation method and application thereof | 成都恒昊创新科技有限公司 | 2023-04-11 | — | — | CN | disclosed |
| CN-112010837-B | Pyridine methylamino phthalide compounds, preparation method and application thereof | 四川大学 | 2021-12-17 | — | — | CN | disclosed |
| CN-113662908-A | Stable butylphthalide small water injection, preparation method and application thereof | 成都施贝康生物医药科技有限公司 | 2021-11-19 | — | — | CN | disclosed |
| CN-112010837-A | Pyridine methylamino phthalide compounds, preparation method and application thereof | 四川大学 | 2020-12-01 | — | — | CN | disclosed |
| CN-112010827-A | Benzylaminophthalide compound, preparation method and application thereof | 四川大学 | 2020-12-01 | — | — | CN | disclosed |
| CN-111943921-A | Preparation method of butylphthalide | 扬子江药业集团有限公司 | 2020-11-17 | — | — | CN | disclosed |
| CN-111574474-A | Micromolecular compound for inhibiting iron death and preparation method and application thereof | 成都恒昊投资有限公司 | 2020-08-25 | — | — | CN | disclosed |
| CN-108383772-A | A kind of N- alkyl phthalic imides preparation method | 江苏海云花新材料有限公司 | 2018-08-10 | — | — | CN | disclosed |
| CN-105916835-A | Hydroxytyrosol derivatives their method of preparation and use in personal care | 伊士曼化工公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-103370312-B | 1,3-diox-5-ketone compound | MERCK PATENT GMBH (DE) | 2015-09-30 | — | — | CN | disclosed |
| CN-103370312-A | 1,3-dioxan-5-one compounds | MERCK PATENT GMBH | 2013-10-23 | — | — | CN | disclosed |
| CN-102746173-A | Emodin derivative and preparation method and application thereof | UNIV HENAN | 2012-10-24 | — | — | CN | disclosed |
| EP-0854177-B1 | Ink compositions | XEROX CORP (US) | 2004-03-31 | — | — | EP | disclosed |