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 SCHEMBL395899 | 0.96 | — | — | |
| Bromide SCHEMBL395865 | 0.88 | — | — | |
| Iodide SCHEMBL395669 | 0.88 | — | — | |
| SCHEMBL350555 | 0.88 | — | — | |
| Benzene SCHEMBL27957887 | 0.86 | KMT2A (0.39) | — | |
| Hydrochloric Acid SCHEMBL2594662 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL6440729 | 0.81 | TSHR (0.57) | — | |
| Hydrochloric Acid SCHEMBL699725 | 0.81 | — | — | |
| Iodide SCHEMBL7684632 | 0.77 | — | — | |
| Bromide SCHEMBL367414 | 0.77 | — | — |
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-1363916-A4 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | UNIV PENNSYLVANIA (US) | 2006-06-28 | — | — | EP | disclosed |
| EP-1363916-A2 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | The Trustees of The University of Pennsylvania (US) | 2003-11-26 | — | — | EP | disclosed |
| WO-2002104072-A2 | EMISSIVE MULTICHROMOPHORIC SYSTEMS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2002-12-27 | — | — | WO | disclosed |