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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL31674658 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL3963721 | 0.98 | — | — | |
| SCHEMBL29886999 | 0.98 | MEN1 (0.30) | — | |
| SCHEMBL3303342 | 0.98 | MEN1 (0.30) | — | |
| Iodide SCHEMBL29751902 | 0.96 | MAPT (0.32) | — | |
| Bromide SCHEMBL30881515 | 0.96 | — | — | |
| Iodide SCHEMBL28665288 | 0.96 | MAPT (0.32) | — | |
| Hydrochloric Acid SCHEMBL31558597 | 0.74 | SIGMAR1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL31558596 | 0.74 | SIGMAR1 (0.30) | — | |
| SCHEMBL19730859 | 0.71 | SIGMAR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009037348-A1 | INDOLINIUM-DERIVED THIOL/DISULFIDE DYE, DYE COMPOSITION COMPRISNG THIS DYE, PROCESS FOR LIGHTENING KERATIN MATERIALS USING THIS DYE | L'OREAL (FR) | 2009-03-26 | — | — | WO | disclosed |
| US-7481847-B2 | Dye composition comprising at least one cationic hydrazone direct dye, dyeing process, and multi-compartment devices | L'OREAL S.A. (FR) | 2009-01-27 | — | — | US | disclosed |
| US-20070234487-A1 | Dye composition comprising at least one cationic hydrazone direct dye, dyeing process, and multi-compartment devices | L'OREAL S.A. (FR) | 2007-10-11 | — | — | US | disclosed |