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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL976934 | 1.00 | — | — | |
| SCHEMBL306673 | 0.97 | TSHR (0.30) | — | |
| Hydrochloric Acid SCHEMBL2105259 | 0.97 | TSHR (0.30) | — | |
| SCHEMBL19583253 | 0.94 | — | — | |
| Water SCHEMBL19510254 | 0.94 | — | — | |
| Bromide SCHEMBL769858 | 0.94 | TP53 (0.33) | — | |
| Water SCHEMBL30230950 | 0.94 | — | — | |
| Water SCHEMBL19583254 | 0.94 | — | — | |
| Bromide SCHEMBL7969436 | 0.94 | TP53 (0.33) | — | |
| SCHEMBL1072918 | 0.94 | TSHR (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6271264-B1 | REMOVING BILE ACIDS FROM PATIENTS | GELTEX PHARMACEUTICALS, INC. | 2001-08-07 | — | — | US | disclosed |
| WO-2000032656-A2 | POLYMERS CONTAINING SPIROBICYCLIC AMMONIUM MOIETIES AND USE THEREOF | GELTEX PHARMACEUTICALS, INC. (US) | 2000-06-08 | — | — | WO | disclosed |