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 SCHEMBL2482252 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8597663 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL7270000 | 0.74 | GPR3 (0.36) | — | |
| Hydrochloric Acid SCHEMBL8678158 | 0.73 | EDNRB (0.30) | — | |
| Hydrochloric Acid SCHEMBL8594297 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL812105 | 0.71 | CYP11B1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7519744 | 0.71 | HTR7 (0.30) | — | |
| Hydrochloric Acid SCHEMBL17698591 | 0.71 | NPC1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL8679012 | 0.71 | — | — | |
| SCHEMBL27475455 | 0.70 | BRD4 (0.36) | — |
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-6492472-B2 | MELT PROCESSABILITY; COORDINATION CATALYST | UNIVATION TECHNOLOGIES, LLC | 2002-12-10 | — | — | US | disclosed |
| US-20020010077-A1 | Mixed catalysts and their use in a polymerization process | LUE CHING-TAI (US) | 2002-01-24 | — | — | US | disclosed |
| US-6207606-B1 | AT LEAST ONE BRIDGED, BULKY LIGAND METALLOCENE-TYPE COMPOUND, AND AT LEAST ONE BRIDGED, ASYMMETRICALLY SUBSTITUTED, BULKY LIGAND METALLOCENE-TYPE COMPOUND | UNIVATION TECHNOLOGIES, LLC | 2001-03-27 | — | — | US | disclosed |
| EP-1084153-A1 | MIXED CATALYSTS AND THEIR USE IN A POLYMERIZATION PROCESS | Univation Technologies LLC (US) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999060032-A1 | MIXED CATALYSTS AND THEIR USE IN A POLYMERIZATION PROCESS | UNIVATION TECHNOLOGIES LLC (US) | 1999-11-25 | — | — | WO | disclosed |