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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 SCHEMBL13721746 | 0.77 | ALDH1A1 (0.32) | ALDH1A1KDM4ECYP11B1CYP11B2RAPGEF4 | |
| Hydrochloric Acid SCHEMBL16340905 | 0.77 | ALDH1A1 (0.33) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL29151039 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL30860724 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL30472444 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL18179634 | 0.74 | KDM4E (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL14024390 | 0.74 | ALDH1A1 (0.41) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL28476099 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL318571 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT | |
| SCHEMBL29445002 | 0.74 | ALDH1A1 (0.33) | ALDH1A1KDM4ERAPGEF4POLBMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016151295-A1 | FLUORINATION PROCESS | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2016-09-29 | — | — | WO | claimed |
| WO-2016151295-A1 | FLUORINATION PROCESS | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2016-09-29 | — | — | WO | disclosed |
| US-7767841-B1 | Gold complexes for catalysIS and preparation thereof | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION, INC. (US) | 2010-08-03 | — | — | US | disclosed |