Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tert-Butyl Hydroperoxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.69 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Hydroperoxide SCHEMBL538709 | 1.00 | ALDH1A1 (0.69) | ALDH1A1TSHRCA1CA2CA9 | |
| Tert-Butyl Hydroperoxide SCHEMBL27609021 | 1.00 | ALDH1A1 (0.69) | ALDH1A1TSHRCA1CA2CA9 | |
| Tert-Butyl Hydroperoxide SCHEMBL28376532 | 0.96 | ALDH1A1 (0.64) | ALDH1A1TSHRCA1CA2CA9 | |
| Cyclohexane SCHEMBL16197528 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2CA9 | |
| Cyclohexane SCHEMBL10008939 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2CA9 | |
| Tert-Butyl Hydroperoxide SCHEMBL2586869 | 0.90 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2CA9 | |
| Tert-Butyl Hydroperoxide SCHEMBL1203656 | 0.89 | ALDH1A1 (0.64) | ALDH1A1TSHRDGAT1HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL3309161 | 0.88 | — | — | |
| Pivalate SCHEMBL27462861 | 0.86 | ALDH1A1 (0.60) | ALDH1A1TSHRDGAT1HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL28766180 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHR |
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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0814101-A2 | Improved polycarboxylic acids | 3V SIGMA S.p.A (IT) | 1997-12-29 | — | — | EP | claimed |
| CN-114026137-B | Acrylic rubber having excellent water resistance | 日本瑞翁株式会社 | 2023-12-29 | — | — | CN | disclosed |
| WO-2023226251-A1 | CERAMIC COMPOSITE RUBBER CONVEYOR BELT COVERING LAYER, AND WEAR-RESISTANT, IMPACT-RESISTANT RUBBER CONVEYOR BELT | 三维控股集团股份有限公司 | 2023-11-30 | — | — | WO | disclosed |
| CN-114854064-A | Prepreg, method for producing same, and fiber-reinforced plastic molded body | 三菱化学株式会社 | 2022-08-05 | — | — | CN | disclosed |
| CN-110088163-B | Curable resin composition, and film, molded article, prepreg, and fiber-reinforced plastic using same | 三菱化学株式会社 | 2022-06-14 | — | — | CN | disclosed |
| CN-112996839-A | Material for forming film for lithography, composition for forming film for lithography, underlayer film for lithography, and pattern formation method | 三菱瓦斯化学株式会社 | 2021-06-18 | — | — | CN | disclosed |
| US-9513407-B2 | Photochromic composition and optical article using photochromic composition | TOKUYAMA CORPORATION (JP) | 2016-12-06 | — | — | US | disclosed |
| US-9120833-B2 | Polyfluoroalkylphosphonic acid ester and process for producing the same | UNIMATEC CO., LTD. (JP) | 2015-09-01 | — | — | US | disclosed |
| EP-2452945-B1 | POLYFLUOROALKYLPHOSPHONIC ACID ESTERS AND PROCESSES FOR PRODUCTION OF SAME | UNIMATEC CO LTD (JP) | 2014-07-30 | — | — | EP | disclosed |
| EP-2700694-A1 | PHOTOCHROMIC COMPOSITION AND OPTICAL ARTICLE USING PHOTOCHROMIC COMPOSITION | Tokuyama Corporation (JP) | 2014-02-26 | — | — | EP | disclosed |
| US-20120108849-A1 | POLYFLUOROALKYLPHOSPHONIC ACID ESTER AND PROCESS FOR PRODUCING THE SAME | UNIMATEC CO., LTD. (JP) | 2012-05-03 | — | — | US | disclosed |
| EP-0814101-A2 | Improved polycarboxylic acids | 3V SIGMA S.p.A (IT) | 1997-12-29 | — | — | EP | disclosed |
| US-5663253-A | THICKENERS | 3V INC. (US) | 1997-09-02 | — | — | US | disclosed |
| EP-0359464-B1 | Heat resistant polyvinyl chloride copolymer and preparation process of the copolymer | MITSUI TOATSU CHEMICALS (JP) | 1994-07-20 | — | — | EP | disclosed |
| US-5166271-A | N-substituted maleimide with vinyl chloride graft polymerized | MITSUI TOATSU CHEMICALS, INC. (JP) | 1992-11-24 | — | — | US | disclosed |
| EP-0359464-A2 | Heat resistant polyvinyl chloride copolymer and preparation process of the copolymer | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-03-21 | — | — | EP | disclosed |
| US-4397965-A | HYDRAZINE DERIVATIVE BLOWING AGENT | UNIROYAL, INC. (US) | 1983-08-09 | — | — | US | disclosed |
| EP-0083173-A1 | Expandable and curable polyester composition and method for making same | UNIROYAL, INC. (US) | 1983-07-06 | — | — | EP | disclosed |
| US-4322502-A | FOAMING AN UNSATURATED POLYESTER DISSOLVED IN UNSATURATED MONOMER,A PEROXIDE, ORGANOMETALLIC PROMOTER, AND A HYDRAZINE OR HYDROAZONE | UNIROYAL, INC. (US) | 1982-03-30 | — | — | US | disclosed |
| EP-0048050-A1 | Simultaneous expansion and cure of polyester resin composition | UNIROYAL, INC. (US) | 1982-03-24 | — | — | EP | disclosed |