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 SCHEMBL3017110 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL4151168 | 0.86 | KIF11 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4159393 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL4297043 | 0.77 | BACE1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL3007817 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL3006824 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL4578271 | 0.58 | GPR3 (0.30) | — | |
| SCHEMBL29385315 | 0.56 | GPR3 (0.38) | — | |
| SCHEMBL5356718 | 0.56 | GPR3 (0.38) | — | |
| SCHEMBL9146467 | 0.55 | GPR3 (0.37) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100190941-A1 | TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER | MITSUI CHEMICALS, INC. | 2010-07-29 | — | — | US | disclosed |
| US-20090043057-A1 | Transition Metal Compound, Catalyst for Olefin Polymerization, and Process for Producing Olefin Polymer | MITSUI CHEMICALS , INC. | 2009-02-12 | — | — | US | disclosed |