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 | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | RAD52 | P43351 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5707910 | 0.99 | GAA (0.50) | GAARAD52KCNH2MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL5707923 | 0.86 | MAPT (0.44) | GAARAD52KCNH2MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL5707938 | 0.85 | GAA (0.53) | GAARAD52KCNH2MAPTMAPK1 | |
| SCHEMBL5707934 | 0.85 | MAPT (0.45) | GAARAD52KCNH2MAPTMAPK1 | |
| SCHEMBL5707925 | 0.84 | GAA (0.54) | GAARAD52KCNH2MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL5707959 | 0.84 | GAA (0.59) | GAARAD52KCNH2MAPTMAPK1 | |
| SCHEMBL5707918 | 0.82 | GAA (0.60) | GAARAD52KCNH2MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL5707937 | 0.82 | GAA (0.56) | GAARAD52KCNH2MAPTMAPK1 | |
| SCHEMBL5707908 | 0.80 | GAA (0.58) | GAARAD52KCNH2MAPTMAPK1 | |
| SCHEMBL5203962 | 0.79 | GAA (0.65) | GAARAD52KCNH2MAPTMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1462445-B1 | Paraphenyldiamine derivatives concisting of a cyclic diaza group substituted by a cationic radical and use of these derivatives for dyeing keratin fibres | OREAL (FR) | 2006-10-18 | — | — | EP | claimed |
| US-7090703-B2 | Para-phenylenediamine derivatives comprising a cyclic diaza group substituted with a cationic radical, and use of these derivatives for dyeing keratin fibers | L'OREAL (FR) | 2006-08-15 | — | — | US | claimed |
| US-7090703-B2 | Para-phenylenediamine derivatives comprising a cyclic diaza group substituted with a cationic radical, and use of these derivatives for dyeing keratin fibers | L'OREAL (FR) | 2006-08-15 | — | — | US | disclosed |