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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.56 |
| ▸ | LOX | P28300 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL9325260 | 0.82 | CA2 (0.78) | CA2LOXPOLBALDH1A1CYP3A4 | |
| SCHEMBL18034192 | 0.77 | CA2 (0.36) | CA2LOXPOLBALDH1A1CYP3A4 | |
| Water SCHEMBL7042206 | 0.76 | CA2 (0.35) | CA2LOXPOLBALDH1A1CYP3A4 | |
| SCHEMBL10792219 | 0.76 | CA2 (0.69) | CA2LOXPOLBALDH1A1CYP3A4 | |
| SCHEMBL12336517 | 0.74 | CA2 (0.67) | CA2LOXPOLBALDH1A1CYP3A4 | |
| SCHEMBL9473149 | 0.74 | CA2 (0.67) | CA2LOXPOLBALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL3425485 | 0.74 | LMNA (0.50) | CA2POLBALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL2593583 | 0.74 | CA2 (0.67) | CA2LOXPOLBALDH1A1CYP3A4 | |
| SCHEMBL8507597 | 0.74 | THRB (0.38) | CA2LOXALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL19844941 | 0.73 | ALDH1A1 (0.37) | CA2LOXALDH1A1CYP3A4CYP2C9 |
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-0471233-B1 | Water-soluble trisazo dyes | CASSELLA FARBWERKE MAINKUR AG (DE) | 1994-11-30 | — | — | EP | disclosed |
| US-5110917-A | Black shades on leather | CASSELLA AKTIENGESELLSCHAFT (DE) | 1992-05-05 | — | — | US | disclosed |