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 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.37 |
| ▸ | HMGCR | P04035 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.30 |
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 | 0.90 | ALDH1A1 (0.69) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL27609021 | 0.90 | ALDH1A1 (0.69) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL2671237 | 0.90 | ALDH1A1 (0.69) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL28376532 | 0.87 | ALDH1A1 (0.64) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Cyclohexane SCHEMBL10008939 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TSHRFFAR3CA1CA2 | |
| Cyclohexane SCHEMBL16197528 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TSHRFFAR3CA1CA2 | |
| Tert-Butyl Hydroperoxide SCHEMBL1203656 | 0.80 | ALDH1A1 (0.64) | ALDH1A1TSHRFFAR3HMGCRCHRM1 | |
| Tert-Butyl Hydroperoxide SCHEMBL3309161 | 0.79 | — | — | |
| Tert-Butyl Hydroperoxide SCHEMBL27930064 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRFFAR3GAALMNA | |
| Malonic Acid SCHEMBL29291513 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRFFAR3HMGCRCHRM1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115895313-B | Resin composition and cured film | 新应材股份有限公司 | 2024-05-10 | — | — | CN | disclosed |
| CN-112334537-B | Propylene polymer composition | 住友化学株式会社 | 2023-07-07 | — | — | CN | disclosed |
| US-10139003-B2 | Lip seal for water pump | EAGLE INDUSTRY CO., LTD. (JP) | 2018-11-27 | — | — | US | disclosed |
| EP-2955420-A1 | LIP SEAL FOR WATER PUMP | Eagle Industry Co., Ltd. (JP) | 2015-12-16 | — | — | EP | disclosed |
| US-20150354706-A1 | LIP SEAL FOR WATER PUMP | EAGLE INDUSTRY CO., LTD. (JP) | 2015-12-10 | — | — | US | disclosed |
| EP-1710482-B1 | LAMINATED TUBE | UBE INDUSTRIES (JP) | 2013-04-17 | — | — | EP | disclosed |
| US-8067075-B2 | Multilayer tube | UBE INDUSTRIES, INC. (JP) | 2011-11-29 | — | — | US | disclosed |
| US-20070148389-A1 | Multilayer tube | Ube Industries, Ltd. a corporation of Japan, 1978-96 (JP) | 2007-06-28 | — | — | US | disclosed |
| EP-1710482-A1 | LAMINATED TUBE | Ube Industries, Ltd. (JP) | 2006-10-11 | — | — | EP | disclosed |
| US-5053167-A | METHOD FOR THE PREPARATION OF AN INTEGRAL RUBBER ARTICLE HAVING ELECTRICALLY INSULATING AND CONDUCTIVE PARTS | SHIN-ETSU POLYMER CO., LTD. (JP) | 1991-10-01 | — | — | US | disclosed |