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.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL8982039 | 0.83 | MAPT (0.36) | MAPTADRA2AADRA2BADRA2CNOX1 | |
| SCHEMBL3112042 | 0.83 | MAPT (0.36) | MAPTADRA2AADRA2BADRA2CNOX1 | |
| Hydrochloric Acid SCHEMBL4227553 | 0.82 | MAPT (0.34) | MAPT | |
| Hydrochloric Acid SCHEMBL1756449 | 0.82 | MAPT (0.35) | MAPTNOX1 | |
| SCHEMBL11286802 | 0.82 | MAPT (0.35) | MAPTNOX1 | |
| SCHEMBL17363623 | 0.81 | MAPT (0.34) | MAPT | |
| SCHEMBL6470714 | 0.79 | LRRK2 (0.36) | MAPT | |
| Hydrochloric Acid SCHEMBL8441856 | 0.72 | MAPT (0.39) | MAPT | |
| Hydromethylthionine SCHEMBL109756 | 0.72 | SNCA (0.50) | MAPTNOX1 | |
| Hydromethylthionine SCHEMBL12592446 | 0.72 | SNCA (0.50) | MAPTNOX1 |
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-7939340-B2 | Hydroxyl radical detection | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2011-05-10 | — | — | US | disclosed |
| US-20080003687-A1 | Hydroxyl radical detection | THE BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY (US) | 2008-01-03 | — | — | US | disclosed |