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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.38 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22734553 | 0.85 | KDM4E (0.41) | MAPTKDM4EMAPK1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4941639 | 0.82 | CSNK1A1 (0.38) | KDM4ESMN1; SMN2CSNK1A1CSNK1DCSNK1E | |
| Hydrochloric Acid SCHEMBL22734515 | 0.82 | RORA (0.44) | MAPTMAPK1SMN1; SMN2CSNK1A1CSNK1D | |
| SCHEMBL22734675 | 0.81 | GAA (0.49) | MAPTKDM4EMAPK1SMN1; SMN2GAA | |
| Hydrochloric Acid SCHEMBL22734538 | 0.75 | ALDH1A1 (0.36) | MAPTKDM4EMAPK1SMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL22734575 | 0.69 | CHRM1 (0.45) | MAPTMAPK1SMN1; SMN2ALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL22734669 | 0.69 | POLB (0.33) | KDM4ESMN1; SMN2CSNK1A1CSNK1DCSNK1E | |
| SCHEMBL3502371 | 0.69 | SMN1; SMN2 (0.38) | MAPTKDM4EMAPK1SMN1; SMN2GAA | |
| SCHEMBL22734676 | 0.68 | ALDH1A1 (0.37) | MAPTKDM4EMAPK1ALDH1A1KMT2A | |
| Trimethylammonium SCHEMBL22734536 | 0.68 | MAPT (0.38) | MAPTKDM4EMAPK1ALDH1A1KMT2A |
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-20200386767-A1 | Analytical method and apparatus using fingerprints on the basis of types in expression levels of express trace proteins and/or peptides contained in living tissue and/or biological fluid | SHINWA CHEMICAL INDUSTRIES LTD. (JP) | 2020-12-10 | — | — | US | disclosed |