Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 5/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18311626 | 0.84 | HSD17B10 (0.44) | ALDH1A1CDC25BPTPN2PTPN1HPGD | |
| SCHEMBL18304735 | 0.83 | KMT2A (0.53) | ALDH1A1KMT2ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL18311755 | 0.81 | KMT2A (0.52) | ALDH1A1LMNACDC25BPTPN2PTPN1 | |
| SCHEMBL18311756 | 0.74 | ADORA3 (0.45) | ALDH1A1CDC25BPTPN2PTPN1SMN1; SMN2 | |
| SCHEMBL18304867 | 0.69 | PDE10A (0.44) | ALDH1A1LMNAKMT2ASMN1; SMN2MAPT | |
| SCHEMBL7406239 | 0.68 | HPGD (0.45) | ALDH1A1LMNAMAPTHPGDGAA | |
| SCHEMBL16590518 | 0.68 | TDP1 (0.57) | ALDH1A1KMT2ASMN1; SMN2MAPTHPGD | |
| SCHEMBL1528353 | 0.67 | KMT2A (0.57) | ALDH1A1KMT2AMAPTHPGDHSD17B10 | |
| SCHEMBL29930960 | 0.67 | KMT2A (0.57) | ALDH1A1KMT2AMAPTHPGDHSD17B10 | |
| SCHEMBL71938 | 0.67 | HSD17B10 (0.60) | ALDH1A1KMT2ASMN1; SMN2MAPTHPGD |
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-2016200717-A1 | AMINOPYRAZINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME CORP. (US) | 2016-12-15 | — | — | WO | disclosed |