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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.46 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.46 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 4/20 | 0.48 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.46 |
| ▸ | MLNR | O43193 | 1/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
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 SCHEMBL29729671 | 0.87 | MEN1 (0.58) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL1123490 | 0.87 | MEN1 (0.58) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL30869258 | 0.87 | MEN1 (0.58) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| Water SCHEMBL8021034 | 0.85 | HTT (0.59) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| SCHEMBL8083797 | 0.85 | DNM1 (0.57) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| SCHEMBL6762129 | 0.85 | DNM1 (0.57) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| Water SCHEMBL11790520 | 0.84 | DNM1 (0.55) | MEN1KMT2AMAPK1SMN1; SMN2TP53 | |
| Hydrogen Sulfide SCHEMBL28259573 | 0.82 | LIPG (0.53) | CNR1KCNH2BCHE | |
| Hydrogen Sulfide SCHEMBL28132195 | 0.82 | LIPG (0.53) | CNR1KCNH2BCHE | |
| Hydrogen Sulfide SCHEMBL28085813 | 0.82 | LIPG (0.53) | CNR1KCNH2BCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0392648-A1 | Metal complexes, the preparation thereof and use as biocides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-10-17 | — | — | EP | disclosed |