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 SCHEMBL649291 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL3893352 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL6714809 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL9581201 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL8219057 | 0.68 | CYP3A4 (0.35) | — | |
| Hydrochloric Acid SCHEMBL7052943 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL618338 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL8157255 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL8378950 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL6355479 | 0.67 | CA4 (0.32) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5807801-A | Catalyst for the polymerization of alpha-olefins | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-15 | — | — | US | disclosed |
| US-5700750-A | Process for polymerization of alpha-olefins | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1997-12-23 | — | — | US | disclosed |
| EP-0250601-B1 | PROCESS FOR POLYMERIZATION OF ALPHA-OLEFINS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-02-26 | — | — | EP | disclosed |
| EP-0250601-A1 | CATALYST FOR POLYMERIZATION OF ALPHA-OLEFINS. | MITSUI PETROCHEMICAL IND (JP) | 1988-01-07 | — | — | EP | disclosed |
| WO-1987003887-A1 | PROCESS FOR POLYMERIZATION OF ALPHA-OLEFINS | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1987-07-02 | — | — | WO | disclosed |