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 | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | G6PD | P11413 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | VDR | P11473 | 1/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL506430 | 0.98 | CA12 (0.47) | CA12CA1CA9GAASTAT3 | |
| SCHEMBL18954290 | 0.88 | ALDH1A1 (0.43) | CA12CA1CA9GAASTAT3 | |
| SCHEMBL18954191 | 0.86 | ALDH1A1 (0.42) | CA12CA1CA9GAASTAT3 | |
| SCHEMBL241884 | 0.85 | CA1 (0.52) | CA12CA1CA9GAASTAT3 | |
| SCHEMBL9118978 | 0.81 | SCN1A (0.46) | ALDH1A1 | |
| SCHEMBL483847 | 0.81 | ALDH1A1 (0.50) | CA12CA1CA9GAASTAT3 | |
| Water SCHEMBL7788572 | 0.81 | CA1 (0.50) | CA12CA1CA9GAASTAT3 | |
| Ethylene SCHEMBL4379131 | 0.81 | CA1 (0.50) | CA12CA1CA9GAASTAT3 | |
| SCHEMBL890725 | 0.81 | ALDH1A1 (0.50) | CA12CA1CA9GAASTAT3 | |
| Ethylene SCHEMBL3466431 | 0.81 | CA1 (0.50) | CA12CA1CA9GAASTAT3 |
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-113322376-B | Method for recovering valuable metals from waste lithium ion battery active materials | 南方科技大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-113322376-A | Method for recovering valuable metals from waste lithium ion battery active materials | 南方科技大学 | 2021-08-31 | — | — | CN | disclosed |