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 SCHEMBL21836737 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL3682111 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL398941 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL1072326 | 0.63 | BACE1 (0.31) | — | |
| SCHEMBL28052634 | 0.62 | BACE1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL1071945 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL6047547 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL18420240 | 0.61 | — | — | |
| SCHEMBL3838477 | 0.59 | — | — | |
| SCHEMBL668815 | 0.59 | MEN1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-RE42957-E1 | Process for producing olefin polymers | MITSUI CHEMICALS, INC. (JP) | 2011-11-22 | — | — | US | disclosed |
| US-7741419-B2 | Copolymerizing ethylene is solution at 120-300 degrees C., with a diarylmethylene- or diarylsilylene-bridged metallocene catalyst and an organoaluminum compound, an alumoxane, or a compound which reacts with the bridged metallocene to form an ion pair; narrow molecular weight distribution. | MITSUI CHEMICALS, INC. (JP) | 2010-06-22 | — | — | US | disclosed |
| US-20060270812-A1 | Copolymerizing ethylene is solution at 120-300 degrees C., with a diarylmethylene- or diarylsilylene-bridged metallocene catalyst and an organoaluminum compound, an alumoxane, or a compound which reacts with the bridged metallocene to form an ion pair; narrow molecular weight distribution. | MITSUI CHEMICALS, INC. (JP) | 2006-11-30 | — | — | US | disclosed |