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 SCHEMBL2387093 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL2388840 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL2388173 | 0.99 | — | — | |
| Bromide SCHEMBL5083605 | 0.98 | — | — | |
| Bromide SCHEMBL5079528 | 0.97 | — | — | |
| Bromide SCHEMBL5080610 | 0.97 | — | — | |
| Bromide SCHEMBL5080419 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL2387905 | 0.96 | — | — | |
| Bromide SCHEMBL5084202 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL5080477 | 0.88 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2570472-A1 | LUBRICATING OIL COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2013-03-20 | — | — | EP | disclosed |
| US-20120135903-A1 | LUBRICATING OIL COMPOSITION | MITSUI CHEMICALS, INC. | 2012-05-31 | — | — | US | disclosed |
| US-8017705-B2 | Process for production of syndiotactic propylene polymer | MITSUI CHEMICALS, INC. (JP) | 2011-09-13 | — | — | US | disclosed |
| US-20100069588-A1 | PROCESS FOR PRODUCTION OF SYNDIOTACTIC PROPYLENE POLYMER | Mitsuri Chemicals Inc. | 2010-03-18 | — | — | US | disclosed |
| US-7393965-B2 | Crosslinked metallocene compound for olefin polymerization and method of polymerizing olefin with the same | MITSUI CHEMICALS, INC. (JP) | 2008-07-01 | — | — | US | disclosed |
| US-20060161013-A1 | Crosslinked metallocene compound for olefin polymerization and method of polymerizing olefin with the same | MITSUI CHEMICALS, INC. (JP) | 2006-07-20 | — | — | US | disclosed |
| US-20020019504-A1 | Stereospecific; low molecular weight | MITSUI CHEMICALS, INC. (JP) | 2002-02-14 | — | — | US | disclosed |