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 SCHEMBL7064323 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL6285707 | 0.74 | CYP11B1 (0.34) | — | |
| SCHEMBL7064113 | 0.73 | — | — | |
| SCHEMBL7064325 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL7065283 | 0.73 | RAB9A (0.42) | — | |
| Hydrochloric Acid SCHEMBL7198909 | 0.71 | CYP1A2 (0.34) | — | |
| Hydrochloric Acid SCHEMBL7195096 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6287765 | 0.69 | HTR2C (0.32) | — | |
| Hydrochloric Acid SCHEMBL7061669 | 0.68 | CHRM2 (0.34) | — | |
| Hydrochloric Acid SCHEMBL6930162 | 0.68 | TACR1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6635733-B2 | Coordination catalyst; radiation transparent, elasticity | CHISSO CORPORATION (JP) | 2003-10-21 | — | — | US | disclosed |
| US-6479646-B1 | Metallocene compounds having indenyl ligand and catalysts for olefin polymerization containing the same | CHISSO CORPORATION (JP) | 2002-11-12 | — | — | US | disclosed |
| US-20020002261-A1 | Elastomeric polypropylene | JNC PETROCHEMICAL CORPORATION (JP) | 2002-01-03 | — | — | US | disclosed |