Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3262058 | 0.92 | CYP2C19 (0.37) | NPSR1CYP2C19LMNACYP1A2MAPT | |
| SCHEMBL2795809 | 0.86 | KDM4E (0.48) | NPSR1CYP2C19LMNACYP1A2MAPT | |
| SCHEMBL2792537 | 0.83 | KDM4E (0.42) | NPSR1CYP2C19LMNACYP1A2MAPT | |
| SCHEMBL2796620 | 0.80 | ALDH1A1 (0.38) | NPSR1CYP2C19LMNACYP1A2MAPT | |
| SCHEMBL3257816 | 0.79 | KDM4E (0.36) | CYP2C19LMNAMAPTHPGDHSD17B10 | |
| SCHEMBL3258125 | 0.75 | ALDH1A1 (0.38) | NPSR1CYP2C19LMNAMAPTHPGD | |
| SCHEMBL3260212 | 0.73 | CRHR1 (0.33) | CDK2 | |
| SCHEMBL4017611 | 0.69 | KDM4E (0.35) | NPSR1CYP2C19LMNACYP1A2MAPT | |
| SCHEMBL2795766 | 0.68 | KDM4E (0.46) | CYP2C19LMNACYP1A2MAPTHPGD | |
| SCHEMBL4019201 | 0.65 | CRHR1 (0.33) | CDK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2014661-A1 | Hererocyclically substituted heterocyclic carboxylic acid derivates | Bayer CropScience AG (DE) | 2009-01-14 | — | — | EP | disclosed |