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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 16/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.39 |
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 SCHEMBL5183165 | 0.84 | RAPGEF4 (0.46) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL502929 | 0.73 | RAPGEF4 (1.00) | RAPGEF4 | |
| SCHEMBL246412 | 0.71 | RAPGEF4 (0.63) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL28587524 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL2090731 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL3212255 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL7023640 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL10626157 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1 | |
| SCHEMBL9643662 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 | |
| SCHEMBL3109416 | 0.69 | RAPGEF4 (0.60) | RAPGEF4ALDH1A1FFAR4 |
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-1866322-A2 | PROCESS FOR PRODUCING SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | ExxonMobil Chemical Patents Inc. (US) | 2007-12-19 | — | — | EP | claimed |
| WO-2006065844-A2 | PROCESS FOR PRODUCING SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-06-22 | — | — | WO | claimed |