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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 4/20 | 0.80 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | DNM1 | Q05193 | 7/20 | 0.55 |
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 SCHEMBL3202201 | 1.00 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL5091328 | 1.00 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL11826400 | 0.97 | SLC22A1 (0.75) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| SCHEMBL2870319 | 0.97 | SLC22A1 (0.86) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| SCHEMBL2870114 | 0.97 | SLC22A1 (0.86) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| SCHEMBL1684241 | 0.97 | SLC22A1 (0.86) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Tetrabuthylammonium SCHEMBL2522406 | 0.97 | SLC22A1 (0.86) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL5087066 | 0.93 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Water SCHEMBL3308155 | 0.93 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 | |
| Hydrochloric Acid SCHEMBL5087568 | 0.93 | SLC22A1 (0.80) | SLC22A1SLC22A2ALDH1A1TP53CYP3A4 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108786834-B | A kind of body phase hydrogenation catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108786930-B | A kind of body phase hydrotreating catalyst and its preparation method | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108786835-B | Body phase hydrogenation catalyst and its preparation method | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108786836-B | A kind of body phase hydrogenation catalyst and its preparation method | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108786931-B | Body phase hydrogenation catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-108786834-A | A kind of body phase hydrogenation catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-108786835-A | Body phase hydrogenation catalyst and its preparation method | 中国石油化工股份有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-108786930-A | A kind of body phase hydrotreating catalyst and its preparation method | 中国石油化工股份有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-108786931-A | Body phase hydrogenation catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-108786836-A | A kind of body phase hydrogenation catalyst and its preparation method | 中国石油化工股份有限公司 | 2018-11-13 | — | — | CN | disclosed |
| US-20080214386-A1 | Stability; easily separated from solution; surface treatment of catalyst with Group seven compound; reacting epoxide with carbon dioxide | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2008-09-04 | — | — | US | disclosed |