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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD52 | P43351 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 16/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.32 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6098198 | 0.82 | FFAR1 (0.40) | GAAFFAR1PPARGKDM4EMAPT | |
| SCHEMBL6604013 | 0.81 | FFAR1 (0.41) | GAAFFAR1PPARGKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL6097647 | 0.79 | RAD52 (0.34) | RAD52GAAKDM4EMAPTTHRB | |
| Hydrochloric Acid SCHEMBL6097618 | 0.78 | GAA (0.34) | RAD52GAA | |
| Hydrochloric Acid SCHEMBL6496609 | 0.77 | RAD52 (0.41) | RAD52GAAFFAR1PPARGNR1I2 | |
| Hydrochloric Acid SCHEMBL6495184 | 0.76 | GAA (0.32) | RAD52GAA | |
| SCHEMBL13638851 | 0.76 | ADORA2A (0.45) | RAD52GAAFFAR1PPARG | |
| Hydrochloric Acid SCHEMBL6504930 | 0.76 | RAD52 (0.40) | RAD52GAAFFAR1PPARGNR1I2 | |
| SCHEMBL2926286 | 0.75 | RAD52 (0.42) | RAD52GAAFFAR1PPARGNR1I2 | |
| Hydrochloric Acid SCHEMBL6503862 | 0.75 | GAA (0.31) | RAD52GAA |
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-7132543-B2 | Para-phenylenediamine derivatives containing a disubstituted pyrrolidinyl group bearing a cationic radical, and use of the same for dyeing keratin fibers | L'OREAL S.A. (FR) | 2006-11-07 | — | — | US | disclosed |