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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 4/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.31 |
| ▸ | SSTR3 | P32745 | 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 | |
|---|---|---|---|---|
| SCHEMBL1517387 | 0.95 | S1PR1 (0.41) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| Perchlorate SCHEMBL6664783 | 0.89 | S1PR1 (0.36) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| SCHEMBL26620784 | 0.86 | S1PR1 (0.37) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| SCHEMBL24317842 | 0.82 | KDM4E (0.36) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| SCHEMBL21660010 | 0.81 | SMN1; SMN2 (0.40) | S1PR1S1PR3EPHX1ALDH1A1FUCA1 | |
| SCHEMBL20063399 | 0.81 | S1PR1 (0.34) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| SCHEMBL1517549 | 0.80 | S1PR1 (0.50) | S1PR1S1PR3EPHX1PIM1CYP1A2 | |
| SCHEMBL19373685 | 0.80 | S1PR1 (0.50) | S1PR1S1PR3EPHX1PIM1CYP1A2 | |
| SCHEMBL20981164 | 0.79 | S1PR1 (0.46) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 | |
| SCHEMBL14130591 | 0.79 | HTR1A (0.46) | S1PR1S1PR3KDM4EEPHX1ALDH1A1 |
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-1160267-B1 | CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE | JAPAN SCIENCE & TECH CORP (JP) | 2004-08-04 | — | — | EP | disclosed |