Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Hydrogen Peroxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL27507933 | 1.00 | — | — | |
| Hydrogen Peroxide SCHEMBL5696297 | 1.00 | — | — | |
| Hydrogen Peroxide SCHEMBL11131971 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL6266028 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL31364942 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL4802832 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL4454275 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL4801490 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL4797694 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL17224686 | 0.75 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108147972-B | Preparation method of vipatavir intermediate and analogue thereof | 成都西岭源药业有限公司 | 2020-07-10 | — | — | CN | disclosed |
| CN-108147972-A | A kind of preparation method of Wei Patawei intermediates and the like | 成都西岭源药业有限公司 | 2018-06-12 | — | — | CN | disclosed |
| CN-106905121-A | A kind of preparation method of benzaldehyde | 南京理工大学 | 2017-06-30 | — | — | CN | disclosed |
| CN-105263489-A | Antimicrobial compositions and methods for their production | NAT UNIV IRELAND | 2016-01-20 | — | — | CN | disclosed |
| WO-2014100150-A1 | DEVICE AND METHODS FOR DETECTION OF ANALYTES INCLUDING USE OF A CLORIMETRIC BARCODE | FLIR DETECTION, INC. (US) | 2014-06-26 | — | — | WO | disclosed |
| EP-1667645-A1 | MATERIALS FOR ENHANCED DELIVERY OF HYDROPHILIC ACTIVE AGENTS IN PERSONAL CARE FORMULATIONS | SYMYX TECHNOLOGIES (US) | 2006-06-14 | — | — | EP | disclosed |
| US-20050152855-A1 | Materials for enhanced delivery of hydrophilic active agents in personal care formulations | FREESLATE, INC. | 2005-07-14 | — | — | US | disclosed |
| WO-2005027864-A1 | MATERIALS FOR ENHANCED DELIVERY OF HYDROPHILIC ACTIVE AGENTS IN PERSONAL CARE FORMULATIONS | SYMYX TECHNOLOGIES, INC. (US) | 2005-03-31 | — | — | WO | disclosed |