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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 9/20 | 0.91 |
| ▸ | CD44 | P16070 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13441 | 0.96 | — | — | |
| Bromide SCHEMBL28557676 | 0.93 | PNMT (0.95) | PNMTCD44MAOBADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL366688 | 0.93 | PNMT (0.95) | PNMTCD44MAOBADRA2AADRA2B | |
| Acetic Acid SCHEMBL28560088 | 0.83 | PNMT (0.75) | PNMTCD44MAOB | |
| SCHEMBL3581219 | 0.83 | PNMT (0.76) | PNMTCD44MAOBADRA2AADRA2B | |
| SCHEMBL997292 | 0.82 | PNMT (0.75) | PNMTCD44MAOB | |
| SCHEMBL23142283 | 0.81 | PNMT (0.73) | PNMTCD44MAOBADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL11178008 | 0.81 | PNMT (0.73) | PNMTCD44MAOBADRA2AADRA2B | |
| Bromide SCHEMBL2263979 | 0.80 | PNMT (0.72) | PNMTCD44MAOB | |
| SCHEMBL11088 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007073095-A1 | PROCESS FOR THE PREPARATION OF (S)-(+)-CLOPIDOGREL ON A SOLID-PHASE | SK CHEMICALS CO., LTD. (KR) | 2007-06-28 | — | — | WO | disclosed |