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 | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 5/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 7/20 | 0.53 |
| ▸ | APP | P05067 | 3/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | QDPR | P09417 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30891532 | 0.98 | CD38 (0.55) | CD38ALOX5APPDPP4SNCA | |
| SCHEMBL6131749 | 0.98 | CD38 (0.55) | CD38ALOX5APPDPP4SNCA | |
| SCHEMBL7045279 | 0.88 | CD38 (0.54) | CD38ALOX5APPDPP4SNCA | |
| SCHEMBL7044449 | 0.88 | CD38 (0.54) | CD38ALOX5APPDPP4SNCA | |
| SCHEMBL8428316 | 0.85 | ALOX5 (0.45) | CD38ALOX5APPMCL1NPC1 | |
| Hydrochloric Acid SCHEMBL6131737 | 0.83 | CD38 (0.62) | CD38ALOX5APPDPP4SNCA | |
| SCHEMBL30884160 | 0.83 | ALOX5 (0.39) | CD38ALOX5SNCAGLO1 | |
| SCHEMBL6131735 | 0.81 | CD38 (0.64) | CD38ALOX5APPDPP4SNCA | |
| Hydrochloric Acid SCHEMBL6131741 | 0.81 | ESR1 (0.46) | CD38APPGLO1NPC1 | |
| SCHEMBL6131734 | 0.79 | ESR1 (0.47) | CD38APPNPC1 |
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-1172090-B1 | Skin dyeing compositions comprising dihydroxyacetone and a flavylium salt non substituted in position 3 | OREAL (FR) | 2005-03-09 | — | — | EP | claimed |
| EP-1172093-B1 | Compositions for coloring the skin containing flavylium salt compounds unsubstituted in position 3 and an organomodified silicone | OREAL (FR) | 2004-12-01 | — | — | EP | claimed |
| EP-1172092-B1 | Compositions for coloring the skin containing at least one UV filter and flavylium salt compounds unsubstituted in position 3 | OREAL (FR) | 2004-09-15 | — | — | EP | claimed |