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 SCHEMBL6903270 | 0.92 | CHRM2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL6903254 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL6901976 | 0.86 | — | — | |
| SCHEMBL6901741 | 0.85 | S1PR1 (0.30) | — | |
| SCHEMBL6904755 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL6897986 | 0.84 | BRD4 (0.31) | — | |
| Hydrochloric Acid SCHEMBL6903464 | 0.83 | NQO2 (0.35) | — | |
| Hydrochloric Acid SCHEMBL6901840 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6901189 | 0.78 | CHRM2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL6897580 | 0.78 | CHRM2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |
| US-6458982-B1 | CATALYST SYSTEM COMPRISING AT LEAST ONE METALLOCENE AND AT LEAST ONE COCATALYST. ON SUPPORT. | TARGOR GMBH (DE) | 2002-10-01 | — | — | US | disclosed |