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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
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 SCHEMBL8396893 | 1.00 | POLB (0.36) | POLBSMN1; SMN2KMT2AMEN1CYP1A2 | |
| Bromide SCHEMBL8398237 | 0.98 | POLB (0.36) | POLBSMN1; SMN2KMT2AMEN1CYP1A2 | |
| Bromide SCHEMBL8398235 | 0.98 | POLB (0.36) | POLBSMN1; SMN2KMT2AMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL8400697 | 0.93 | GRIN2D (0.35) | POLBSMN1; SMN2KMT2AMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL8400698 | 0.93 | GRIN2D (0.35) | POLBSMN1; SMN2KMT2AMEN1CYP1A2 | |
| Bromide SCHEMBL8396028 | 0.91 | GRIN2D (0.35) | POLBSMN1; SMN2KMT2AMEN1SIGMAR1 | |
| Bromide SCHEMBL8396030 | 0.91 | GRIN2D (0.35) | POLBSMN1; SMN2KMT2AMEN1SIGMAR1 | |
| Bromide SCHEMBL8400689 | 0.84 | CHRM3 (0.33) | — | |
| Bromide SCHEMBL8400687 | 0.84 | CHRM3 (0.33) | — | |
| Bromide SCHEMBL7658481 | 0.84 | SMN1; SMN2 (0.40) | POLBSMN1; SMN2KMT2AMEN1MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5990124-A | ALKOXY AND/OR ACYLOXY DI- AND POLY-SUBSTITUTED ARALKYL AND ARALKENYL BIS-QUATERNARY AMMONIUM DERIVATIVES OF CYCLIC ALKANOL DIESTERS; SUCH AS BIS(N-(4-ACETOXY-3-METHOXYBENZYL) TROPANIUM-3-YL)-3,6-ENDOMETHYLENE-1,2,3,6-TETRAHYDROPHTHALATE | GYERMEK LASZLO (US) | 1999-11-23 | — | — | US | disclosed |