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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL8717248 | 0.98 | CA12 (0.42) | CA12CA1CA9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL25405687 | 0.86 | CA12 (0.42) | CA12CA1CA9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL25324285 | 0.84 | CA12 (0.44) | CA12CA1CA9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1535756 | 0.84 | CA12 (0.40) | CA12CA1CA9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6265698 | 0.82 | CA12 (0.39) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL5485564 | 0.82 | CA12 (0.45) | CA12CA1CA9CA2ALDH1A1 | |
| SCHEMBL1713038 | 0.81 | CA12 (0.41) | CA12CA1CA9CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL25406366 | 0.80 | CA12 (0.38) | CA12CA1CA9CA2ALDH1A1 | |
| Fluoride Ion SCHEMBL5446663 | 0.79 | CA12 (0.40) | CA12CA1CA9CA2ALDH1A1 | |
| Bromide SCHEMBL6155069 | 0.79 | CA12 (0.40) | CA12CA1CA9CA2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5726856-A | Hexasubstituted guanidinium salts and ultracapacitors employing them as electrolytes | GENERAL ELECTRIC COMPANY (US) | 1998-03-10 | — | — | US | disclosed |