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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 13/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 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 SCHEMBL9523964 | 0.93 | THRA (0.35) | THRATHRBVDROPRM1OPRK1 | |
| Hydrochloric Acid SCHEMBL10401314 | 0.89 | THRA (0.34) | THRATHRBVDROPRM1OPRK1 | |
| Hydrochloric Acid SCHEMBL9523922 | 0.84 | TSHR (0.33) | OPRM1OPRK1TSHRNPSR1ROCK2 | |
| SCHEMBL9528889 | 0.83 | TSHR (0.33) | OPRM1OPRK1TSHRNPSR1ROCK2 | |
| Hydrochloric Acid SCHEMBL9525305 | 0.82 | TSHR (0.33) | OPRM1OPRK1TSHRNPSR1ROCK2 | |
| Hydrochloric Acid SCHEMBL9528597 | 0.77 | TSHR (0.39) | OPRM1OPRK1TSHRNPSR1ROCK2 | |
| Hydrochloric Acid SCHEMBL9525481 | 0.77 | SLC18A2 (0.31) | TSHRNPSR1 | |
| Hydrochloric Acid SCHEMBL9524987 | 0.77 | OPRM1 (0.34) | OPRM1OPRK1TSHRNPSR1DHODH | |
| Hydrochloric Acid SCHEMBL9523744 | 0.77 | OPRM1 (0.34) | OPRM1OPRK1TSHRNPSR1OPRD1 | |
| Hydrochloric Acid SCHEMBL9525127 | 0.76 | TSHR (0.31) | OPRM1OPRK1TSHRNPSR1 |
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 |