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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.34 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.34 |
| ▸ | DNM1 | Q05193 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
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 SCHEMBL1832866 | 0.88 | DNM1 (0.39) | DNM1MEN1KMT2ATP53MAPK1 | |
| Cetrimonium SCHEMBL330808 | 0.83 | LIPG (0.45) | DNM1HTTAPAF1HSP90AA1RAD52 | |
| SCHEMBL330544 | 0.83 | LIPG (0.45) | DNM1HTTAPAF1HSP90AA1RAD52 | |
| SCHEMBL330654 | 0.83 | LIPG (0.45) | DNM1HTTAPAF1HSP90AA1RAD52 | |
| Cetrimonium SCHEMBL5384565 | 0.81 | DNM1 (0.40) | DNM1MEN1KMT2ATP53MAPK1 | |
| SCHEMBL5383904 | 0.81 | DNM1 (0.40) | DNM1MEN1KMT2ATP53MAPK1 | |
| SCHEMBL11667568 | 0.78 | POLB (0.41) | MEN1KMT2A | |
| Potassium Ion SCHEMBL1373901 | 0.78 | POLB (0.41) | MEN1KMT2A | |
| SCHEMBL9318297 | 0.78 | POLB (0.41) | MEN1KMT2A | |
| Zinc Ion SCHEMBL3800912 | 0.78 | POLB (0.41) | MEN1KMT2A |
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-2318498-A1 | FABRIC CARE COMPOSITIONS, PROCESS OF MAKING, AND METHOD OF USE | The Procter & Gamble Company (US) | 2011-05-11 | — | — | EP | disclosed |
| WO-2010025116-A1 | FABRIC CARE COMPOSITIONS, PROCESS OF MAKING, AND METHOD OF USE | THE PROCTER & GAMBLE COMPANY (US) | 2010-03-04 | — | — | WO | disclosed |