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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL6151474 | 0.94 | ALDH1A1 (0.38) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| Hydrochloric Acid SCHEMBL28637822 | 0.71 | NPSR1 (0.40) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| Hydrochloric Acid SCHEMBL29226730 | 0.67 | ALDH1A1 (0.60) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| SCHEMBL453160 | 0.65 | ALDH1A1 (0.67) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| SCHEMBL301494 | 0.65 | ALDH1A1 (0.45) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| SCHEMBL9490577 | 0.65 | ALDH1A1 (0.67) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| SCHEMBL30959 | 0.65 | ALDH1A1 (0.67) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| Benzene SCHEMBL28083527 | 0.65 | ALDH1A1 (0.67) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| Hydrochloric Acid SCHEMBL9198699 | 0.65 | ALDH1A1 (0.39) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A | |
| Hydrochloric Acid SCHEMBL7639263 | 0.65 | ALDH1A1 (0.39) | ALDH1A1NPSR1ALOX15L3MBTL1KMT2A |
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-1054853-B1 | CATALYST RECOVERY FOR HALOGEN EXCHANGE REACTIONS | ALBEMARLE CORP (US) | 2003-03-19 | — | — | EP | disclosed |
| US-6215032-B1 | SOLVENT EXTRACTION; SEPARATING AMINOPHOSPHONIUM CATALYST; FLUORINATION OF HALOAROMATIC COMPOUND BY REPLACEMENT REACTION WITH ALKALI METAL FLUORIDE | ALBEMARLE CORPORATION | 2001-04-10 | — | — | US | disclosed |