Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F12 | P00748 | 15/20 | 0.36 |
| ▸ | F2 | P00734 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21494400 | 0.83 | F12 (0.36) | F12F2 | |
| SCHEMBL3139041 | 0.82 | CA1 (0.33) | F2CA1CA2HTR6 | |
| Hydrochloric Acid SCHEMBL27907053 | 0.81 | CA1 (0.33) | F2CA1CA2HTR6 | |
| SCHEMBL10812390 | 0.72 | F12 (0.36) | F12F2KDM1A | |
| SCHEMBL1140930 | 0.72 | KDM1A (0.41) | F12KDM1A | |
| SCHEMBL30268332 | 0.72 | KDM1A (0.41) | F12KDM1A | |
| Sulfamide SCHEMBL28712871 | 0.71 | MEN1 (0.43) | CA1CA2KDM1A | |
| Hydrochloric Acid SCHEMBL27979019 | 0.71 | KDM1A (0.40) | F12KDM1A | |
| SCHEMBL768982 | 0.70 | ALDH1A1 (0.54) | F12F2 | |
| SCHEMBL30020668 | 0.70 | ALDH1A1 (0.54) | F12F2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108503584-A | A kind of 1,2,3,4- tetrahydroquinolines sulfamide compound and its application | 复旦大学 | 2018-09-07 | — | — | CN | claimed |
| CN-108503584-A | A kind of 1,2,3,4- tetrahydroquinolines sulfamide compound and its application | 复旦大学 | 2018-09-07 | — | — | CN | disclosed |
| EP-2563761-A1 | ACTIVATORS OF HUMAN PYRUVATE KINASE | The U.S.A. As Represented By The Secretary, Department Of Health And Human Services (US) | 2013-03-06 | — | — | EP | disclosed |
| WO-2011137089-A1 | ACTIVATORS OF HUMAN PYRUVATE KINASE | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-11-03 | — | — | WO | disclosed |