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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.30 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.30 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 SCHEMBL9407490 | 0.90 | KMT2A (0.34) | MEN1KMT2AMTNR1AMTNR1BALDH1A1 | |
| Hydrochloric Acid SCHEMBL9407578 | 0.89 | KMT2A (0.38) | MEN1KMT2AMTNR1AMTNR1BALDH1A1 | |
| Iodide SCHEMBL9407503 | 0.89 | KMT2A (0.34) | MEN1KMT2AMTNR1AMTNR1BALDH1A1 | |
| Iodide SCHEMBL9407569 | 0.88 | KMT2A (0.34) | MEN1KMT2AMTNR1AMTNR1BALDH1A1 | |
| Iodide SCHEMBL9407534 | 0.87 | KMT2A (0.38) | MEN1KMT2AMTNR1AMTNR1BALDH1A1 | |
| Hydrochloric Acid SCHEMBL9525722 | 0.87 | NPSR1 (0.42) | MEN1KMT2AALDH1A1MAPTADRB2 | |
| Iodide SCHEMBL9525405 | 0.86 | MEN1 (0.37) | MEN1KMT2AMTNR1AMTNR1BMAPT | |
| Hydrochloric Acid SCHEMBL9525961 | 0.85 | CHRNB2 (0.42) | MTNR1AMTNR1BHSP90AA1MAPTHDAC1 | |
| Hydrochloric Acid SCHEMBL9525272 | 0.84 | TSHR (0.38) | MEN1KMT2AALDH1A1MAPTADRB2 | |
| Hydrochloric Acid SCHEMBL9525649 | 0.83 | ADRA2A (0.32) | MEN1KMT2AALDH1A1MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0301751-A1 | Pyridinium derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |