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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 7/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16834246 | 0.76 | ALDH1A1 (0.37) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL5790127 | 0.76 | ALDH1A1 (0.37) | ALDH1A1NPSR1MAPTPOLBHTT | |
| Hydrochloric Acid SCHEMBL2796752 | 0.74 | ALDH1A1 (0.36) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL4227079 | 0.72 | ALDH1A1 (0.35) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL4222761 | 0.72 | ALDH1A1 (0.35) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL4219437 | 0.72 | ALDH1A1 (0.35) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL1662433 | 0.71 | ALDH1A1 (0.34) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL29713642 | 0.71 | ALDH1A1 (0.34) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL2796756 | 0.71 | ALDH1A1 (0.34) | ALDH1A1NPSR1MAPTPOLBHTT | |
| SCHEMBL820145 | 0.70 | ALDH1A1 (0.35) | ALDH1A1NPSR1MAPTPOLBHTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7767841-B1 | Gold complexes for catalysIS and preparation thereof | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION, INC. (US) | 2010-08-03 | — | — | US | disclosed |