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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | CHKA | P35790 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL22340811 | 0.99 | NPC1 (0.32) | ACHEALDH1A1SMN1; SMN2HTTLMNA | |
| Hydrochloric Acid SCHEMBL22322837 | 0.88 | KDM4E (0.35) | MAPTNPC1GAAL3MBTL1HPGD | |
| SCHEMBL22340392 | 0.86 | KDM4E (0.35) | SMN1; SMN2MAPTNPC1GAAL3MBTL1 | |
| SCHEMBL22322859 | 0.86 | ALDH1A1 (0.31) | ACHEALDH1A1MAPTGAAL3MBTL1 | |
| SCHEMBL22340393 | 0.84 | LTB4R (0.33) | — | |
| SCHEMBL22340705 | 0.84 | ALDH1A1 (0.38) | ACHEALDH1A1SMN1; SMN2HTTLMNA | |
| SCHEMBL22340630 | 0.80 | KDM4E (0.43) | ALDH1A1SMN1; SMN2HTTLMNAMAPT | |
| SCHEMBL22322834 | 0.80 | CYP11B2 (0.32) | — | |
| SCHEMBL22340380 | 0.78 | LTB4R (0.34) | ALDH1A1SMN1; SMN2HTTLMNAMAPT | |
| SCHEMBL22322810 | 0.74 | KDM4E (0.34) | ALDH1A1GAAHPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020161162-A1 | HERBICIDAL PYRIDINIUM COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2020-08-13 | — | — | WO | disclosed |