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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 SCHEMBL28930333 | 0.74 | ALDH1A1 (0.58) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| SCHEMBL455687 | 0.74 | KDM4E (0.59) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| Hydrochloric Acid SCHEMBL7723830 | 0.73 | ALDH1A1 (0.34) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| Hydrochloric Acid SCHEMBL4084545 | 0.72 | ALDH1A1 (0.33) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| Hydrochloric Acid SCHEMBL27613793 | 0.72 | KDM4E (0.56) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| SCHEMBL6641842 | 0.72 | KDM4E (0.56) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| Hydrochloric Acid SCHEMBL7719477 | 0.71 | ALDH1A1 (0.34) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| Hydrochloric Acid SCHEMBL1071221 | 0.70 | ALDH1A1 (0.36) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| SCHEMBL9298315 | 0.69 | KDM4E (0.48) | ALDH1A1TSHRKDM4EALOX15ACMSD | |
| SCHEMBL28244305 | 0.69 | KDM4E (0.48) | ALDH1A1TSHRKDM4EALOX15ACMSD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1417213-B1 | METHOD FOR MAKING LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION | EQUISTAR CHEM LP (US) | 2005-01-19 | — | — | EP | disclosed |
| US-6562973-B1 | Reacting a 2,6-diacylpyridine, an aniline, and a Group VIII metal compound selected from the group consisting of iron(II) and cobalt(II) compounds, in one reaction step in a single reactor that is equipped with an internal filter,to produce a | EQUISTAR CHEMICALS, LP | 2003-05-13 | — | — | US | disclosed |