Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.44 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4462375 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL817880 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4457155 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4460489 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4464834 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL817724 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4465697 | 1.00 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4453485 | 0.98 | TSHR (0.42) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL4461104 | 0.91 | TSHR (0.42) | TSHRLPAR3LPAR2ALDH1A1LMNA | |
| SCHEMBL8898479 | 0.86 | TSHR (0.46) | TSHRLPAR3LPAR2ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2195323-A2 | NOVEL POLYSPIRANE COMPOUNDS, APPLICATION THEREOF IN THE TREATMENT OF MALARIA OR TOXOPLASMOSIS AND METHOD FOR PREPARING SAME | Université Joseph Fourier (FR) | 2010-06-16 | — | — | EP | disclosed |
| WO-2009077677-A2 | NOVEL POLYSPIRANE COMPOUNDS, APPLICATION THEREOF IN THE TREATMENT OF MALARIA OR TOXOPLASMOSIS AND METHOD FOR PREPARING SAME | UNIVERSITE JOSEPH FOURIER (FR) | 2009-06-25 | — | — | WO | disclosed |