Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.46 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6421132 | 0.81 | NUDT1 (0.52) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL6417970 | 0.77 | NUDT1 (0.57) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL6421135 | 0.76 | NUDT1 (0.47) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL15823357 | 0.75 | P2RX7 (0.52) | NUDT1KMT2AMEN1L3MBTL1MTNR1A | |
| SCHEMBL14878884 | 0.73 | KDM4E (0.50) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL14823123 | 0.72 | KDM4E (0.52) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL10289966 | 0.71 | KDM4E (0.51) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL6416789 | 0.71 | KDM4E (0.51) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL394886 | 0.70 | KDM4E (0.50) | NUDT1GABRA1GABRB2GABRB1GABRA3 | |
| SCHEMBL28489854 | 0.70 | KDM4E (0.50) | NUDT1GABRA1GABRB2GABRB1GABRA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007081335-A1 | THERAPEUTIC COMPOUNDS FOR TREATING DYSLIPIDEMIC CONDITIONS | MERCK & CO., INC. (US) | 2007-07-19 | — | — | WO | disclosed |