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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.35 |
| ▸ | PHF8 | Q9UPP1 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 SCHEMBL8540925 | 0.97 | DNM1 (0.38) | CA12CA1CA9MAPTKDM5A | |
| SCHEMBL3480441 | 0.94 | CA12 (0.42) | CA12CA1CA9MAPTKDM5A | |
| SCHEMBL218572 | 0.94 | CA12 (0.42) | CA12CA1CA9MAPTKDM5A | |
| SCHEMBL219200 | 0.94 | CA12 (0.42) | CA12CA1CA9MAPTKDM5A | |
| Hydrochloric Acid SCHEMBL11442180 | 0.90 | DNM1 (0.41) | CA12CA1CA9MAPTKDM5A | |
| Ammonia Solution, Strong SCHEMBL2783719 | 0.90 | CA12 (0.40) | CA12CA1CA9MAPTKDM5A | |
| Bromide SCHEMBL28564341 | 0.90 | DNM1 (0.41) | CA12CA1CA9MAPTKDM5A | |
| Fluoride SCHEMBL7561486 | 0.90 | CA12 (0.40) | CA12CA1CA9MAPTKDM5A | |
| Hydrochloric Acid SCHEMBL8540929 | 0.90 | DNM1 (0.41) | CA12CA1CA9MAPTKDM5A | |
| Arsenic SCHEMBL15988577 | 0.90 | CA12 (0.40) | CA12CA1CA9MAPTKDM5A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5814226-A | Method of removing heavy metal ions from a liquid with chemically active ceramic compositions with a thiol and/or amine moiety | SYRACUSE UNIVERSITY (US) | 1998-09-29 | — | — | US | disclosed |
| US-5616533-A | Chemically active ceramic compositions with a thiol and/or amine moiety | SYRACUSE UNIVERSITY (US) | 1997-04-01 | — | — | US | disclosed |