Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.45 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3170981 | 0.90 | HTT (0.49) | MEN1KMT2ASMN1; SMN2KDM4EP2RY12 | |
| SCHEMBL3165495 | 0.88 | TDP1 (0.45) | SMN1; SMN2KDM4ETSHRTP53ALDH1A1 | |
| SCHEMBL3169774 | 0.87 | ADORA2A (0.43) | KDM4EP2RY12MAPTTSHRTP53 | |
| SCHEMBL3163481 | 0.85 | ADORA2A (0.41) | P2RY12TSHRTP53ALDH1A1HSD17B10 | |
| SCHEMBL3162937 | 0.85 | ADORA2A (0.46) | KDM4EP2RY12MAPTTSHRTP53 | |
| SCHEMBL3174594 | 0.84 | ADORA2A (0.45) | KDM4EP2RY12MAPTTSHRTP53 | |
| SCHEMBL3175769 | 0.84 | ADORA2A (0.45) | KDM4EP2RY12MAPTTSHRTP53 | |
| SCHEMBL3166225 | 0.84 | ADORA2A (0.45) | KDM4EP2RY12MAPTTSHRTP53 | |
| SCHEMBL3172373 | 0.84 | GRIN2D (0.49) | MEN1KMT2AMAPTNPSR1 | |
| SCHEMBL3162870 | 0.84 | NPSR1 (0.44) | MEN1KMT2AKDM4EP2RY12NPSR1 |
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-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |