Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 6/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.41 |
| ▸ | MINK1 | Q8N4C8 | 3/20 | 0.41 |
| ▸ | TNIK | Q9UKE5 | 3/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 2/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20012012 | 1.00 | IDO1 (0.45) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL19995233 | 0.89 | IDO1 (0.45) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL30060976 | 0.89 | IDO1 (0.45) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL26030813 | 0.84 | IDO1 (0.53) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL30062972 | 0.82 | IDO1 (0.40) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL19995259 | 0.82 | IDO1 (0.40) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL19995446 | 0.76 | KMT2A (0.46) | MAPK1MAPK14MAPT | |
| SCHEMBL22068158 | 0.75 | IDO1 (0.55) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL30298973 | 0.74 | IDO1 (0.52) | IDO1ADORA2BADORA2AMAP4K4MINK1 | |
| SCHEMBL1226158 | 0.73 | ADORA2B (0.49) | IDO1ADORA2BADORA2AMAP4K4MINK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110036006-B | Preparation and use of pyrimidinone derivatives | 癌症研究科技有限公司 | 2022-12-13 | — | — | CN | disclosed |