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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 4/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4133422 | 0.98 | CHRNA7 (0.48) | CHRNA7CYP1A2CYP2D6ALDH1A1LMNA | |
| Sulfuric Acid SCHEMBL11346791 | 0.87 | CHRNA7 (0.42) | CHRNA7CYP1A2CYP2D6ALDH1A1LMNA | |
| Sulfuric Acid SCHEMBL11383711 | 0.86 | CHRNA7 (0.41) | CHRNA7CYP1A2CYP2D6 | |
| Sulfuric Acid SCHEMBL11331738 | 0.86 | CYP1A2 (0.42) | CHRNA7CYP1A2CYP2D6 | |
| SCHEMBL16673968 | 0.85 | CHRNA7 (0.53) | CHRNA7CYP1A2CYP2D6BCHEACHE | |
| Sulfuric Acid SCHEMBL11331697 | 0.84 | CYP1A2 (0.41) | CHRNA7CYP1A2CYP2D6 | |
| Sulfuric Acid SCHEMBL11380811 | 0.84 | CYP1A2 (0.41) | CHRNA7CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL32681176 | 0.79 | CHRNA7 (0.46) | CHRNA7CYP1A2CYP2D6LMNAACHE | |
| Hydrochloric Acid SCHEMBL688013 | 0.79 | CHRNA7 (0.46) | CHRNA7CYP1A2CYP2D6BCHEACHE | |
| SCHEMBL19942443 | 0.76 | CHRNA7 (0.47) | CHRNA7CYP1A2CYP2D6BCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| JP-8109335-A | — | — | None | — | — | JP | disclosed |
| JP-H08109335-A | CATIONIC DYESTUFF | HODOGAYA CHEM CO LTD | 1996-04-30 | — | — | JP | disclosed |
| US-4228230-A | Ultrasonic imaging of internally fogged silver halide elements | EASTMAN KODAK COMPANY (US) | 1980-10-14 | — | — | US | disclosed |