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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.31 |
| ▸ | SLC6A3 known ✓ | Q01959 | 3/20 | 0.31 |
| ▸ | DKK1 | O94907 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.30 |
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 SCHEMBL7936830 | 0.67 | SLC6A3 (0.32) | SLC6A2SLC6A3NISCH | |
| Hydrochloric Acid SCHEMBL7936368 | 0.64 | CTRC (0.32) | — | |
| Hydrochloric Acid SCHEMBL7935996 | 0.64 | NISCH (0.33) | DKK1NISCH | |
| Hydrochloric Acid SCHEMBL7926442 | 0.61 | PTPN1 (0.31) | NISCH | |
| Anthracene SCHEMBL10324152 | 0.56 | CYP2A6 (0.44) | — | |
| SCHEMBL5013872 | 0.56 | ESR1 (0.71) | — | |
| SCHEMBL30239993 | 0.56 | ESR1 (0.71) | — | |
| SCHEMBL239121 | 0.56 | ESR1 (0.71) | — | |
| SCHEMBL15902840 | 0.56 | ESR1 (0.71) | — | |
| SCHEMBL30239998 | 0.56 | ESR1 (0.71) | — |
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 |