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 | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.42 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MC4R | P32245 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8664739 | 0.98 | SLC22A1 (0.44) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| SCHEMBL9409911 | 0.89 | SLC22A1 (0.52) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| SCHEMBL8671957 | 0.83 | SLC22A1 (0.56) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| SCHEMBL8671617 | 0.83 | SLC22A1 (0.56) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| SCHEMBL14948313 | 0.83 | PSMD14 (0.43) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| Tetrabuthylammonium SCHEMBL8027007 | 0.83 | SLC22A1 (0.63) | SLC22A1HPGDTP53SMN1; SMN2HTT | |
| Hydrochloric Acid SCHEMBL8665765 | 0.82 | PSMD14 (0.41) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| Hydrochloric Acid SCHEMBL8959213 | 0.82 | KCNH2 (0.56) | SLC22A1PSMD14HSP90AA1MMP2MC4R | |
| Hydrochloric Acid SCHEMBL194044 | 0.82 | MEN1 (0.59) | SLC22A1MEN1KMT2ATP53MAPK1 | |
| SCHEMBL12704909 | 0.80 | CYP2A6 (0.43) | SLC22A1HPGDTP53MAPK1SMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-7076557-A | — | — | None | — | — | JP | disclosed |
| US-5545502-A | CONTAINING SPECIFIED QUATERNARY AMMONIUM SALT AS CHARGE CONTROL AGENT | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-08-13 | — | — | US | disclosed |
| EP-0602566-B1 | Electrostatic image-developing toner | MITSUBISHI CHEM CORP (JP) | 1996-07-31 | — | — | EP | disclosed |
| JP-H0776557-A | PRODUCTION OF QUATERNARY AMMONIUM COMPOUND | MITSUBISHI CHEM CORP | 1995-03-20 | — | — | JP | disclosed |
| EP-0602566-A1 | Electrostatic image-developing toner | Mitsubishi Chemical Corporation (JP) | 1994-06-22 | — | — | EP | disclosed |