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 | |
|---|---|---|---|---|
| SCHEMBL412825 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL23683 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL27779639 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL8424965 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL16397661 | 0.67 | — | — | |
| Water SCHEMBL25188536 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11760072 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL5187483 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3659162 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL8183313 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0272697-B1 | MONOAZO LAKE PIGMENT | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1993-06-23 | — | — | EP | disclosed |
| US-5084106-A | Dyes for inks for printing, paints and plastics | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1992-01-28 | — | — | US | disclosed |
| EP-0272697-A2 | Monoazo lake pigment | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1988-06-29 | — | — | EP | disclosed |