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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 SCHEMBL4615371 | 0.84 | TSHR (0.47) | TSHRACACBALDH1A1MAPK1TDP1 | |
| Hydrochloric Acid SCHEMBL1483412 | 0.81 | TSHR (0.52) | TSHRACACBALDH1A1MAPK1TDP1 | |
| Bromide SCHEMBL6117220 | 0.81 | TSHR (0.47) | TSHRACACBALDH1A1MAPK1TDP1 | |
| SCHEMBL2140805 | 0.79 | TSHR (0.54) | TSHRACACBALDH1A1MAPK1TDP1 | |
| Hydrogen Sulfide SCHEMBL28195736 | 0.79 | TSHR (0.58) | TSHRACACBALDH1A1MAPK1TDP1 | |
| Water SCHEMBL31228205 | 0.78 | TSHR (0.52) | TSHRACACBALDH1A1MAPK1TDP1 | |
| SCHEMBL319728 | 0.77 | — | — | |
| SCHEMBL8401460 | 0.77 | — | — | |
| SCHEMBL1315706 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL6117944 | 0.76 | TSHR (0.39) | TSHRALDH1A1MAPK1TDP1ZDHHC20 |
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-8722824-B2 | Relative permeability modifiers based on hydrophobically modified cationic copolymers | ENI S.P.A. (IT) | 2014-05-13 | — | — | US | disclosed |
| US-20120130037-A1 | RELATIVE PERMEABILITY MODIFIERS BASED ON HYDROPHOBICALLY MODIFIED CATIONIC COPOLYMERS | ENI S.P.A. (IT) | 2012-05-24 | — | — | US | disclosed |