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 SCHEMBL18586574 | 0.79 | BRD4 (0.32) | — | |
| Fluoride Ion SCHEMBL1130745 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL7920127 | 0.76 | MEN1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL7925111 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7925113 | 0.75 | — | — | |
| Fluoride Ion SCHEMBL1131046 | 0.73 | — | — | |
| Fluoride Ion SCHEMBL1130823 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL721237 | 0.72 | HTR2A (0.33) | — | |
| Hydrochloric Acid SCHEMBL611048 | 0.72 | HTR2A (0.33) | — | |
| Hydrochloric Acid SCHEMBL27409197 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1509552-A1 | SOLID, PARTICULATED, SPRAY DRIED, HETEROGENOUS CATALYST COMPOSITION | Univation Technologies LLC (US) | 2005-03-02 | — | — | EP | disclosed |
| WO-2003102037-A1 | SOLID, PARTICULATED, SPRAY DRIED, HETEROGENOUS CATALYST COMPOSITION | UNIVATION TECHNOLOGIES, LLC (US) | 2003-12-11 | — | — | WO | disclosed |
| US-5672669-A | CONTACTING ETHYLENE WITH A SPRAY DRIED METALLOCENE CATALYST AND A COCATALYST CAPABLE OF ACTIVATING THE CATALYST, AND AN INERT FILLER PARTICLES, HOMO OR COPOLYMERIZATION | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1997-09-30 | — | — | US | disclosed |