Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.56 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.51 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.51 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.51 |
| ▸ | DHFR | P00374 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7690924 | 0.87 | ALDH1A1 (0.62) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL7695598 | 0.85 | ALDH1A1 (0.62) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL7693967 | 0.83 | DHFR (0.55) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL5767471 | 0.78 | DHFR (0.51) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL5766855 | 0.78 | DHFR (0.51) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL7698578 | 0.78 | ALDH1A1 (0.57) | ALDH1A1ALOX12CACNA1FCACNA1DCACNA1S | |
| SCHEMBL5766699 | 0.77 | SMN1; SMN2 (0.65) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL5766912 | 0.76 | ALDH1A1 (0.49) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL5766842 | 0.76 | ALDH1A1 (0.49) | ALDH1A1ALOX12DHFRSMN1; SMN2MAPT | |
| SCHEMBL7694814 | 0.76 | DHFR (0.67) | ALDH1A1ALOX12CACNA1FCACNA1DCACNA1S |
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-2002066443-A2 | 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES | ONO PHARMACEUTICAL CO., LTD. (JP) | 2002-08-29 | — | — | WO | disclosed |