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 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | GFER | P55789 | 3/20 | 0.44 |
| ▸ | RAD52 | P43351 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5707934 | 0.99 | MAPT (0.45) | MAPTKDM4EGAAGFERRAD52 | |
| Hydrochloric Acid SCHEMBL5707922 | 0.86 | GAA (0.49) | MAPTKDM4EGAARAD52ALDH1A1 | |
| SCHEMBL6692925 | 0.85 | KDM4E (0.53) | MAPTKDM4EGAAGFERRAD52 | |
| SCHEMBL5707910 | 0.85 | GAA (0.50) | MAPTKDM4EGAARAD52ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5707931 | 0.83 | MAPT (0.48) | MAPTKDM4EGAAGFERRAD52 | |
| SCHEMBL5707919 | 0.82 | MAPT (0.49) | MAPTKDM4EGAAGFERRAD52 | |
| Hydrochloric Acid SCHEMBL5707968 | 0.81 | MAPT (0.54) | MAPTKDM4EGAAGFERRAD52 | |
| SCHEMBL5707929 | 0.80 | MAPT (0.55) | MAPTKDM4EGAAGFERRAD52 | |
| Hydrochloric Acid SCHEMBL5707957 | 0.79 | KDM4E (0.51) | MAPTKDM4EGAAGFERRAD52 | |
| SCHEMBL5707941 | 0.78 | KDM4E (0.53) | MAPTKDM4EGAAGFERRAD52 |
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 |