Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27535417 | 0.92 | — | — | |
| SCHEMBL18510170 | 0.91 | — | — | |
| SCHEMBL20411614 | 0.91 | — | — | |
| SCHEMBL2401765 | 0.91 | KDM4E (0.54) | — | |
| SCHEMBL4397 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL10746719 | 0.87 | — | — | |
| SCHEMBL8063647 | 0.87 | — | — | |
| SCHEMBL10956055 | 0.87 | — | — | |
| Bromide SCHEMBL6544774 | 0.87 | — | — | |
| Methyl Alcohol SCHEMBL10966612 | 0.87 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115819188-B | Preparation method of 4-tert-butyl-2- (alpha-methylbenzyl) phenol | 达高工业技术研究院(广州)有限公司 | 2023-08-15 | — | — | CN | claimed |
| CN-115819188-B | Preparation method of 4-tert-butyl-2- (alpha-methylbenzyl) phenol | 达高工业技术研究院(广州)有限公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-114230496-B | Aromatic sulfinic acid compound and preparation method thereof | 达高工业技术研究院(广州)有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-115819188-A | Preparation method of 4-tert-butyl-2- (alpha-methylbenzyl) phenol | 达高工业技术研究院(广州)有限公司 | 2023-03-21 | — | — | CN | disclosed |
| CN-114230496-A | Aromatic sulfinic acid compound and preparation method thereof | 达高工业技术研究院(广州)有限公司 | 2022-03-25 | — | — | CN | disclosed |