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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 3/20 | 0.35 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | METAP2 | P50579 | 1/20 | 0.30 |
| ▸ | METAP1 | P53582 | 1/20 | 0.30 |
| ▸ | CBFB | Q13951 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.30 |
| ▸ | TGFBR1 | P36897 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30472785 | 1.00 | AMY1A (0.35) | AMY1ADHODHSTAT3STAT1KMO | |
| Hydrochloric Acid SCHEMBL29210018 | 0.99 | AMY1A (0.34) | AMY1ADHODHSTAT3STAT1KMO | |
| SCHEMBL30472787 | 0.99 | AMY1A (0.36) | AMY1ADHODHSTAT3STAT1KMO | |
| SCHEMBL29209967 | 0.99 | AMY1A (0.36) | AMY1ADHODHSTAT3STAT1KMO | |
| SCHEMBL30472781 | 0.93 | AMY1A (0.33) | AMY1ADHODHSTAT3STAT1 | |
| SCHEMBL27477373 | 0.87 | STAT3 (0.33) | AMY1ASTAT3STAT1 | |
| Hydrochloric Acid SCHEMBL29209979 | 0.84 | STAT3 (0.36) | STAT3STAT1ALDH1A1MAPK14 | |
| SCHEMBL31147672 | 0.84 | STAT3 (0.38) | STAT3STAT1 | |
| SCHEMBL899157 | 0.83 | NPC1 (0.42) | DHODHSTAT3STAT1ALDH1A1MAPK14 | |
| Hydrochloric Acid SCHEMBL29209973 | 0.82 | STAT3 (0.36) | STAT3STAT1ALDH1A1MAPK14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116284017-B | Method for preparing amide compound by utilizing enzyme-like efficient catalytic oxidation | 中国科学院青岛生物能源与过程研究所 | 2024-03-22 | — | — | CN | disclosed |
| CN-116284017-A | Method for preparing amide compound by utilizing enzyme-like efficient catalytic oxidation | 中国科学院青岛生物能源与过程研究所 | 2023-06-23 | — | — | CN | disclosed |