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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
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 SCHEMBL9524572 | 0.97 | ALDH1A1 (0.35) | ALDH1A1ADRB2CTSKCHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL9525722 | 0.86 | NPSR1 (0.42) | ALDH1A1ADRB2MAPTEPHX2NPC1 | |
| Hydrochloric Acid SCHEMBL9525961 | 0.85 | CHRNB2 (0.42) | CTSKCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL9525171 | 0.85 | NPC1 (0.41) | ALDH1A1ADRB2HRH3HRH4NPC1 | |
| Iodide SCHEMBL9407503 | 0.84 | KMT2A (0.34) | ALDH1A1ADRB2CHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL9525253 | 0.83 | MEN1 (0.33) | ALDH1A1ADRB2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL9525835 | 0.83 | HRH3 (0.42) | ALDH1A1ADRB2HRH3HRH4MAPT | |
| Hydrochloric Acid SCHEMBL9525272 | 0.82 | TSHR (0.38) | ALDH1A1ADRB2MAPTNPC1LMNA | |
| Hydrochloric Acid SCHEMBL9525055 | 0.82 | TSHR (0.41) | ALDH1A1ADRB2CHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL9524738 | 0.82 | FAAH (0.43) | — |
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-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |