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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 known ✓ | Q01959 | 3/20 | 0.32 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.32 |
| ▸ | CHRM3 known ✓ | P20309 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8168093 | 0.80 | SLC6A4 (0.34) | SLC6A4SLC6A3CHRM3 | |
| SCHEMBL6469961 | 0.79 | CHRM3 (0.34) | SLC6A4SLC6A3CYP2D6CHRM3 | |
| SCHEMBL7575276 | 0.78 | CHRM3 (0.33) | SLC6A4SLC6A3SLC6A2CHRM3 | |
| SCHEMBL7582393 | 0.77 | CHRM3 (0.34) | SLC6A4SLC6A3SLC6A2CHRM3 | |
| SCHEMBL6470858 | 0.77 | CHRM3 (0.34) | SLC6A4SLC6A3SLC6A2CHRM3 | |
| SCHEMBL7571273 | 0.75 | NR1I2 (0.32) | CHRM3 | |
| SCHEMBL8775944 | 0.74 | SLC6A4 (0.36) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL7572692 | 0.74 | CHRM3 (0.31) | CHRM3 | |
| SCHEMBL7571348 | 0.74 | — | — | |
| SCHEMBL7579331 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1123938-A2 | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM COMPANY (US) | 2001-08-16 | — | — | EP | disclosed |