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 | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | BAX | Q07812 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL28588806 | 0.92 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL29232696 | 0.86 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| Potassium Ion SCHEMBL187986 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL187417 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL31538469 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| Lithium Ion SCHEMBL188290 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL414391 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL188076 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| Lithium Ion SCHEMBL28887480 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 | |
| SCHEMBL29118344 | 0.81 | LTA4H (0.43) | LTA4HTSHRCA4SRCKCNA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108780924-B | Electrolyte containing magnesium ions | 富士胶片和光纯药株式会社 | 2021-09-24 | — | — | CN | disclosed |