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 | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP9 | P14780 | 2/20 | 0.42 |
| ▸ | MMP14 | P50281 | 2/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 5/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 SCHEMBL9320000 | 0.99 | MMP2 (0.43) | MMP2MMP9MMP14S1PR3NPC1 | |
| Hydrochloric Acid SCHEMBL9320020 | 0.89 | MMP9 (0.42) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL10628616 | 0.89 | MMP9 (0.43) | MMP2MMP9MMP14S1PR3LMNA | |
| SCHEMBL9319965 | 0.87 | MLNR (0.43) | MMP2MMP9MMP14S1PR3LMNA | |
| SCHEMBL4629619 | 0.86 | S1PR3 (0.50) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL9352787 | 0.86 | S1PR3 (0.50) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL9352816 | 0.86 | S1PR3 (0.50) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL4628634 | 0.85 | S1PR3 (0.49) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL10499202 | 0.85 | S1PR3 (0.49) | MMP2MMP9MMP14S1PR3NPC1 | |
| SCHEMBL8958935 | 0.85 | S1PR3 (0.49) | MMP2MMP9MMP14S1PR3NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0284132-A2 | Quaternary ammonium or phosphonium peroxy carbonic acid precursors and their use in detergent bleach compositions | UNILEVER N.V. (NL) | 1988-09-28 | — | — | EP | disclosed |