Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Sulfuric 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 | |
|---|---|---|---|---|
| ▸ | MAOA known ✓ | P21397 | 3/20 | 0.60 |
| ▸ | SCN1A known ✓ | P35498 | 3/20 | 0.58 |
| ▸ | SCN2A known ✓ | Q99250 | 3/20 | 0.58 |
| ▸ | SCN3A known ✓ | Q9NY46 | 3/20 | 0.58 |
| ▸ | SCN7A known ✓ | Q01118 | 1/20 | 0.53 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.53 |
| ▸ | SCN5A known ✓ | Q14524 | 1/20 | 0.53 |
| ▸ | SCN9A known ✓ | Q15858 | 1/20 | 0.53 |
| ▸ | SCN8A known ✓ | Q9UQD0 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | HTR3A | P46098 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 2/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 5/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL1022754 | 0.93 | HRH3 (0.65) | MAOAHRH3TSHRCYP2D6HTR3A | |
| Bicarbonate SCHEMBL1021919 | 0.92 | HRH3 (0.63) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL10645561 | 0.83 | HPGD (0.68) | MAOAHRH3TSHRCYP2D6HTR3A | |
| Procaine SCHEMBL6537522 | 0.82 | CYP2D6 (0.89) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL4295410 | 0.82 | HRH3 (0.68) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL94128 | 0.82 | HRH3 (0.68) | MAOAHRH3TSHRCYP2D6HTR3A | |
| P-Butylaminobenzoyldiethylaminoethyl SCHEMBL503019 | 0.82 | SCN1A (0.79) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL4916550 | 0.82 | HRH3 (0.60) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL6677 | 0.81 | HRH3 (0.67) | MAOAHRH3TSHRCYP2D6HTR3A | |
| SCHEMBL9576578 | 0.81 | HRH3 (0.71) | MAOAHRH3TSHRCYP2D6HTR3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1776333-B1 | AMMONIUM SALTS AND AMMONIUM SALT/MINERAL SALT CLATHRATE COMPOUNDS FOR USE AS VEHICLE AND EFFECTIVE FORM FOR PHARMACO-MEDICAL APPLICATIONS AND FOR USE AS PHASE TRANSFER AGENTS FOR CHEMICAL APPLICATIONS | KASCH HELMUT (DE) | 2011-01-12 | — | — | EP | disclosed |
| EP-1776333-A2 | AMMONIUM SALTS AND AMMONIUM SALT/MINERAL SALT CLATHRATE COMPOUNDS FOR USE AS VEHICLE AND EFFECTIVE FORM FOR PHARMACO-MEDICAL APPLICATIONS AND FOR USE AS PHASE TRANSFER AGENTS FOR CHEMICAL APPLICATIONS | Kasch, Helmut (DE) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006007835-A2 | AMMONIUM SALTS AND AMMONIUM SALT/MINERAL SALT CLATHRATE COMPOUNDS FOR USE AS VEHICLE AND EFFECTIVE FORM FOR PHARMACO-MEDICAL APPLICATIONS AND FOR USE AS PHASE TRANSFER AGENTS FOR CHEMICAL APPLICATIONS | KASCH HELMUT (DE) | 2006-01-26 | — | — | WO | disclosed |