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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.39 |
| ▸ | TACR1 known ✓ | P25103 | 1/20 | 0.35 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 SCHEMBL7338415 | 0.83 | SNCA (0.49) | PNMTIDO1SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL7199763 | 0.83 | SNCA (0.41) | IDO1ALDH1A1KCNH2TAAR1NPC1 | |
| Bromide SCHEMBL1508970 | 0.80 | SNCA (0.51) | PNMTIDO1SLC6A2SLC6A4SLC6A3 | |
| Iodide SCHEMBL7201618 | 0.80 | SNCA (0.41) | IDO1ALDH1A1KCNH2TAAR1NPC1 | |
| Bromide SCHEMBL7197866 | 0.80 | SNCA (0.43) | IDO1ALDH1A1KCNH2TAAR1NPC1 | |
| Hydrochloric Acid SCHEMBL6061532 | 0.80 | SNCA (0.44) | IDO1SLC6A2SLC6A4SLC6A3TAAR1 | |
| Hydrochloric Acid SCHEMBL7198842 | 0.76 | MAPT (0.47) | SLC6A4ALDH1A1MAPTGAACYP2C19 | |
| Hydrochloric Acid SCHEMBL2447879 | 0.76 | SNCA (0.44) | IDO1SLC6A2SLC6A4SLC6A3MEN1 | |
| Bromide SCHEMBL6061034 | 0.76 | SNCA (0.47) | IDO1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29427125 | 0.76 | SNCA (0.44) | IDO1SLC6A2SLC6A4SLC6A3MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5336671-A | Fungicidal compositions containing benzyl-tris(aryl)phosphonium salts | SHELL RESEARCH LIMITED (GB) | 1994-08-09 | — | — | US | disclosed |
| EP-0444749-A1 | Fungicidal compositions containing benzyl-tris(aryl) phosphonium salts | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-09-04 | — | — | EP | disclosed |
| US-4187300-A | Use of phosphonium salts in treatment of African trypanosomiasis | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1980-02-05 | — | — | US | disclosed |