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 SCHEMBL28420597 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL4461337 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL4540913 | 0.70 | — | — | |
| SCHEMBL3843097 | 0.67 | — | — | |
| SCHEMBL4069979 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL28420598 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL617246 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL7635493 | 0.65 | PREP (0.31) | — | |
| Hydrochloric Acid SCHEMBL8466558 | 0.61 | CYP2D6 (0.34) | — | |
| Hydrochloric Acid SCHEMBL7061166 | 0.61 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0611377-B1 | PROCESS FOR PRODUCING POLYOLEFIN | EXXONMOBIL CHEM PATENTS INC (US) | 2001-08-01 | — | — | EP | disclosed |
| EP-0316155-B1 | A transition-metal compound having a substituted, bridged bis-cyclopentadienyl ligand | CHISSO CORP (JP) | 1996-02-07 | — | — | EP | disclosed |
| US-5359015-A | Homo- or copolymerization of ethylene using Group 4 or 5 transition metal cyclopentadienyl catalyst with activator | EXXON CHEMICAL PATENTS INC. (US) | 1994-10-25 | — | — | US | disclosed |
| EP-0611377-A1 | PROCESS FOR PRODUCING POLYOLEFIN | EXXON CHEMICAL PATENTS INC. (US) | 1994-08-24 | — | — | EP | disclosed |
| US-5281679-A | Catalyst comprises metallocene having at least one cyclopentadiene ring, and aluminoxane activator | EXXON CHEMICAL PATENTS INC. (US) | 1994-01-25 | — | — | US | disclosed |
| WO-1993009148-A1 | PROCESS FOR PRODUCING POLYOLEFIN | EXXON CHEMICAL PATENTS INC. (US) | 1993-05-13 | — | — | WO | disclosed |
| US-4931417-A | Transition-metal compound having a bis-substituted-cyclopentadienyl ligand of bridged structure | CHISSO CORPORATION (JP) | 1990-06-05 | — | — | US | disclosed |
| EP-0316155-A2 | A transition-metal compound having a substituted, bridged bis-cyclopentadienyl ligand | Chisso Corporation (JP) | 1989-05-17 | — | — | EP | disclosed |