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 SCHEMBL7926820 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL27521327 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL27537084 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7936596 | 0.79 | DKK1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL7938819 | 0.77 | NISCH (0.34) | — | |
| Hydrochloric Acid SCHEMBL27546207 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL27537105 | 0.73 | CYP2A6 (0.35) | — | |
| Hydrochloric Acid SCHEMBL27546010 | 0.73 | ACHE (0.35) | — | |
| Hydrochloric Acid SCHEMBL27519667 | 0.71 | NISCH (0.38) | — | |
| Hydrochloric Acid SCHEMBL7935455 | 0.70 | — | — |
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-6184402-B1 | RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES | CHISSO CORPORATION (JP) | 2001-02-06 | — | — | US | disclosed |