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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 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 SCHEMBL7936075 | 0.88 | CYP3A4 (0.31) | CYP3A4PTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL7935322 | 0.84 | TP53 (0.33) | — | |
| Hydrochloric Acid SCHEMBL7936959 | 0.77 | CYP3A4 (0.35) | CYP3A4PTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL7933256 | 0.74 | PTPN1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL7926943 | 0.73 | RAB9A (0.32) | — | |
| Hydrochloric Acid SCHEMBL7938864 | 0.73 | CYP3A4 (0.35) | CYP3A4 | |
| Hydrochloric Acid SCHEMBL7935704 | 0.69 | NISCH (0.33) | CYP3A4 | |
| Hydrochloric Acid SCHEMBL7935513 | 0.65 | TP53 (0.32) | CYP3A4PTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL7933136 | 0.64 | CYP3A4 (0.35) | CYP3A4 | |
| Hydrochloric Acid SCHEMBL7936962 | 0.64 | PTGS1 (0.33) | CYP3A4PTGS1PTGS2 |
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-6184402-B1 | RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES | CHISSO CORPORATION (JP) | 2001-02-06 | — | — | US | disclosed |