Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.88 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.88 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15107850 | 0.94 | MAPT (1.00) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12417294 | 0.93 | MAPT (0.76) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12508077 | 0.92 | MAPT (0.79) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12417293 | 0.87 | MAPT (0.87) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12417291 | 0.85 | MAPT (0.69) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL15107847 | 0.82 | MAPT (0.89) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL13845572 | 0.81 | MAPT (0.79) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12507765 | 0.76 | MAPT (1.00) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12417295 | 0.75 | MAPT (0.76) | MAPTNPSR1MAPK1KDM4ELMNA | |
| SCHEMBL12417297 | 0.74 | MAPT (0.89) | MAPTNPSR1MAPK1KDM4ELMNA |
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-8486987-B2 | Mechanism-based small-molecule parasite inhibitors | UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) | 2013-07-16 | — | — | US | disclosed |
| WO-2009065096-A1 | MECHANISM-BASED SMALL-MOLECULE PARASITE INHIBITORS | UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) | 2009-05-22 | — | — | WO | disclosed |