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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 11/20 | 0.81 |
| ▸ | ADRA2B known ✓ | P18089 | 11/20 | 0.81 |
| ▸ | ADRA2C known ✓ | P18825 | 11/20 | 0.81 |
| ▸ | PLAU | P00749 | 8/20 | 0.81 |
| ▸ | NOS3 | P29474 | 2/20 | 0.50 |
| ▸ | NOS1 | P29475 | 2/20 | 0.50 |
| ▸ | NOS2 | P35228 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2226462 | 0.90 | ADRA2A (1.00) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL4021935 | 0.75 | ADRA2A (0.70) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL1703431 | 0.75 | ADRA2A (0.70) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL11304297 | 0.72 | ADRA2A (0.66) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL27565778 | 0.72 | MAOA (0.50) | ADRA2AADRA2BADRA2CPLAUKCNH2 | |
| SCHEMBL206947 | 0.71 | ADRA2A (0.59) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL3065415 | 0.71 | — | — | |
| 2-Aminopyridine SCHEMBL5289614 | 0.70 | NOS3 (0.73) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL4316417 | 0.70 | ADRA2A (0.63) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| 2-Aminopyridine SCHEMBL28064312 | 0.70 | NOS3 (0.73) | ADRA2AADRA2BADRA2CPLAUNOS3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4341769-A | VASODILATOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-07-27 | — | — | US | disclosed |
| EP-0038161-A1 | 2,6-Diaminonebularines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1981-10-21 | — | — | EP | disclosed |